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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-06 15:16:51 UTC

Update Date

2022-03-07 02:51:52 UTC

HMDB ID

HMDB0015129

Secondary Accession Numbers

HMDB15129

Metabolite Identification

Common Name

Neomycin

Description

Neomycin, also known as fradiomycin b or framycetine, belongs to the class of organic compounds known as 4,5-disubstituted 2-deoxystreptamines. These are 2-deoxystreptamine aminoglycosides that are glycosidically linked to a pyranose of furanose unit at the C4- and C5-positions. Neomycin is a drug which is used for the treatment of bacterial blepharitis, bacterial bonjunctivitis, corneal injuries, corneal ulcers and meibomianitis. for the prophylaxis of ocular infections following foreign body removal. In humans, neomycin is involved in the neomycin action pathway. Neomycin is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review a significant number of articles have been published on Neomycin.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

452
  Mrv0541 02231214412D          

 42 45  0  0  1  0            999 V2000
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 40 42  1  6  0  0  0
M  END

HMDB0015129
     RDKit          3D
Neomycin
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M  END

452
  Mrv0541 02231214412D          

 42 45  0  0  1  0            999 V2000
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   12.0095    0.7213    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6349   -1.1857    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.9203   -1.5982    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.9203   -2.4232    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.3493   -1.5982    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.3493   -2.4232    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.6349   -2.8358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3493    0.0518    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.2426    1.0438    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.4356    0.8723    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.6551    0.3293    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.3808   -1.1857    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9684   -0.4712    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1433   -0.4712    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.3986    1.8838    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7308   -1.1857    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1433   -1.9002    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.7341    2.6375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.5547    2.7237    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.4756    0.2431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0397    2.0563    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.7040    1.3025    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.7308   -2.6147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1890    0.6351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20  1  1  6  0  0  0
 26  1  1  1  0  0  0
 21  2  1  1  0  0  0
 30  2  1  1  0  0  0
  3 26  1  0  0  0  0
  3 29  1  0  0  0  0
 27  4  1  6  0  0  0
 33  4  1  6  0  0  0
 23  5  1  1  0  0  0
  6 30  1  0  0  0  0
  6 35  1  0  0  0  0
  7 33  1  0  0  0  0
  7 40  1  0  0  0  0
 28  8  1  6  0  0  0
 32  9  1  6  0  0  0
 34 10  1  1  0  0  0
 37 11  1  1  0  0  0
 12 38  1  0  0  0  0
 39 13  1  6  0  0  0
 22 14  1  6  0  0  0
 24 15  1  6  0  0  0
 31 16  1  1  0  0  0
 36 17  1  6  0  0  0
 18 41  1  0  0  0  0
 19 42  1  0  0  0  0
 20 21  1  0  0  0  0
 20 23  1  0  0  0  0
 21 22  1  0  0  0  0
 22 25  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 26 28  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 38  1  1  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 34  1  0  0  0  0
 33 36  1  0  0  0  0
 34 35  1  0  0  0  0
 35 41  1  6  0  0  0
 36 37  1  0  0  0  0
 37 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 42  1  6  0  0  0
M  END
> <DATABASE_ID>
HMDB0015129

> <DATABASE_NAME>
hmdb

> <SMILES>
NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C23H46N6O13/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22/h5-23,30-36H,1-4,24-29H2/t5-,6+,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1

> <INCHI_KEY>
PGBHMTALBVVCIT-VCIWKGPPSA-N

> <FORMULA>
C23H46N6O13

> <MOLECULAR_WEIGHT>
614.6437

> <EXACT_MASS>
614.312285588

> <JCHEM_ACCEPTOR_COUNT>
19

> <JCHEM_AVERAGE_POLARIZABILITY>
60.86944937466069

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
13

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3S,4R,5S)-5-{[(1R,2R,3S,5R,6S)-3,5-diamino-2-{[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}-6-hydroxycyclohexyl]oxy}-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}oxane-3,4-diol

> <ALOGPS_LOGP>
-2.81

> <JCHEM_LOGP>
-8.415177746000001

> <ALOGPS_LOGS>
-0.98

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
6

> <JCHEM_PKA>
13.193966104089196

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.29108347065852

> <JCHEM_PKA_STRONGEST_BASIC>
9.968574453874519

> <JCHEM_POLAR_SURFACE_AREA>
353.10999999999996

> <JCHEM_REFRACTIVITY>
135.9002999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
6.47e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
neomycin

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0015129
     RDKit          3D
Neomycin
 88 91  0  0  0  0  0  0  0  0999 V2000
    6.7688    2.2645    3.6521 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9019    0.8719    3.2446 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5269    0.7604    1.7685 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.2299    1.1803    1.6035 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6541    0.8242    0.4066 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.6604   -0.1008    0.6369 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3990    0.3450    0.2572 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3671    0.2163    1.3314 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2510    1.5039    2.1589 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1786    1.3427    3.0406 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1691    0.0772    0.6641 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3730   -0.6051   -0.5135 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.4401   -0.1374   -1.4824 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3472   -0.9774   -2.0804 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.1071   -1.1501   -3.5487 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3471   -2.4537   -3.9725 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8063   -0.2054   -4.4602 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.1861    1.0918   -4.5611 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2934   -0.0913   -4.1388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6355   -0.9047   -2.9209 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.0266   -0.7810   -2.5476 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7142   -0.4434   -1.8084 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.2429   -0.8115   -0.5655 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6330    0.2992    0.1736 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.0347    0.3919    0.2384 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6181   -0.4007    1.1829 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.1337   -0.2229    1.0203 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5606   -0.6172   -0.2961 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2385    0.0038    2.5917 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.0184   -1.0896    3.4198 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0316    0.9222    2.5620 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.3720    2.2343    2.3390 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0162    0.4138    1.5214 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4614   -0.8475    2.0262 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8426   -0.5746   -0.8098 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4536   -1.8151   -0.6245 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6972    0.3303   -0.5750 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1453    0.1708   -1.8962 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3588   -0.9094   -0.0721 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.5560   -1.0697   -0.7999 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7491   -0.6805    1.3717 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0411   -1.5276    2.2134 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5233    2.7982    3.1517 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8695    2.6632    3.3197 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9986    0.6321    3.3302 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3148    0.1844    3.8742 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    1.3890    1.2263 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2383    1.7696   -0.0500 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4019    1.3588   -0.1618 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5708   -0.6332    2.0216 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9696    2.3240    1.4646 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1450    1.6988    2.7525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0168    2.1421    3.5554 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1257   -1.6730   -0.3309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3070   -2.0108   -1.6415 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0040   -0.9422   -3.6885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5539   -3.0045   -3.8329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7669   -0.6342   -5.4843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5102    1.2932   -3.7997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8636    1.8623   -4.7312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5483    0.9673   -3.9277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9342   -0.4513   -4.9681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4204   -1.9633   -3.1292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5425   -1.5639   -3.0067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3833    0.0958   -2.9988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7498    0.6647   -1.8479 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3575    1.2311   -0.4120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3820   -1.4536    1.0264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3794    0.8558    1.1483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6661   -0.8222    1.7934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3723    0.1512   -0.9850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1581   -1.5260   -0.6131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0670    0.6019    3.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4232   -0.9360    4.2900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5330    0.8470    3.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3406    2.4234    2.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1810    1.1526    1.5825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2181   -1.5469    2.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1638   -0.6204    3.0221 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0942   -0.2449   -1.8280 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7729   -2.4041   -0.1941 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4770    1.1315   -0.6395 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9153   -0.0239   -2.5586 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7142    1.0739   -2.1834 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7228   -1.8114   -0.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5364   -1.8990   -1.3271 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8407   -0.8866    1.5413 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2705   -1.0881    2.6542 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
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  3  4  1  0
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 41  3  1  0
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  3 47  1  6
  5 48  1  6
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M  END

HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 452                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  O   UNK     0      12.385  -0.673   0.000  0.00  0.00           O+0
HETATM    2  O   UNK     0       9.718  -2.213   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0      15.126  -0.530   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      16.012   3.355   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0      15.052  -2.213   0.000  0.00  0.00           O+0
HETATM    6  O   UNK     0       7.407  -3.547   0.000  0.00  0.00           O+0
HETATM    7  O   UNK     0      18.449   2.270   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0      12.735   2.659   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0       5.098   0.454   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0       3.557  -2.213   0.000  0.00  0.00           O+0
HETATM   11  O   UNK     0      20.328   6.491   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0      18.314  -0.953   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0      22.139   3.999   0.000  0.00  0.00           O+0
HETATM   14  N   UNK     0      10.281  -5.857   0.000  0.00  0.00           N+0
HETATM   15  N   UNK     0      15.052  -5.293   0.000  0.00  0.00           N+0
HETATM   16  N   UNK     0       8.177   0.454   0.000  0.00  0.00           N+0
HETATM   17  N   UNK     0      17.265   6.169   0.000  0.00  0.00           N+0
HETATM   18  N   UNK     0       5.868  -6.215   0.000  0.00  0.00           N+0
HETATM   19  N   UNK     0      22.418   1.346   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0      12.385  -2.213   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      11.051  -2.983   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      11.051  -4.523   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      13.719  -2.983   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      13.719  -4.523   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      12.385  -5.293   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      13.719   0.097   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      15.386   1.948   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      13.880   1.628   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      16.156   0.615   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       8.177  -2.213   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       7.408  -0.880   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       5.867  -0.880   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      17.544   3.516   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       5.097  -2.213   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0       5.867  -3.547   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      18.170   4.923   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      19.702   5.084   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      17.688   0.454   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      20.607   3.838   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      19.981   2.431   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       5.097  -4.881   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0      20.886   1.186   0.000  0.00  0.00           C+0
CONECT    1   20   26                                                       
CONECT    2   21   30                                                       
CONECT    3   26   29                                                       
CONECT    4   27   33                                                       
CONECT    5   23                                                            
CONECT    6   30   35                                                       
CONECT    7   33   40                                                       
CONECT    8   28                                                            
CONECT    9   32                                                            
CONECT   10   34                                                            
CONECT   11   37                                                            
CONECT   12   38                                                            
CONECT   13   39                                                            
CONECT   14   22                                                            
CONECT   15   24                                                            
CONECT   16   31                                                            
CONECT   17   36                                                            
CONECT   18   41                                                            
CONECT   19   42                                                            
CONECT   20    1   21   23                                                  
CONECT   21    2   20   22                                                  
CONECT   22   14   21   25                                                  
CONECT   23    5   20   24                                                  
CONECT   24   15   23   25                                                  
CONECT   25   22   24                                                       
CONECT   26    1    3   28                                                  
CONECT   27    4   28   29                                                  
CONECT   28    8   26   27                                                  
CONECT   29    3   27   38                                                  
CONECT   30    2    6   31                                                  
CONECT   31   16   30   32                                                  
CONECT   32    9   31   34                                                  
CONECT   33    4    7   36                                                  
CONECT   34   10   32   35                                                  
CONECT   35    6   34   41                                                  
CONECT   36   17   33   37                                                  
CONECT   37   11   36   39                                                  
CONECT   38   12   29                                                       
CONECT   39   13   37   40                                                  
CONECT   40    7   39   42                                                  
CONECT   41   18   35                                                       
CONECT   42   19   40                                                       
MASTER        0    0    0    0    0    0    0    0   42    0   90    0
END

COMPND    HMDB0015129
HETATM    1  N1  UNL     1       6.769   2.265   3.652  1.00  0.00           N  
HETATM    2  C1  UNL     1       6.902   0.872   3.245  1.00  0.00           C  
HETATM    3  C2  UNL     1       6.527   0.760   1.769  1.00  0.00           C  
HETATM    4  O1  UNL     1       5.230   1.180   1.604  1.00  0.00           O  
HETATM    5  C3  UNL     1       4.654   0.824   0.407  1.00  0.00           C  
HETATM    6  O2  UNL     1       3.660  -0.101   0.637  1.00  0.00           O  
HETATM    7  C4  UNL     1       2.399   0.345   0.257  1.00  0.00           C  
HETATM    8  C5  UNL     1       1.367   0.216   1.331  1.00  0.00           C  
HETATM    9  C6  UNL     1       1.251   1.504   2.159  1.00  0.00           C  
HETATM   10  O3  UNL     1       0.179   1.343   3.041  1.00  0.00           O  
HETATM   11  O4  UNL     1       0.169   0.077   0.664  1.00  0.00           O  
HETATM   12  C7  UNL     1       0.373  -0.605  -0.513  1.00  0.00           C  
HETATM   13  O5  UNL     1      -0.440  -0.137  -1.482  1.00  0.00           O  
HETATM   14  C8  UNL     1      -1.347  -0.977  -2.080  1.00  0.00           C  
HETATM   15  C9  UNL     1      -1.107  -1.150  -3.549  1.00  0.00           C  
HETATM   16  O6  UNL     1      -1.347  -2.454  -3.972  1.00  0.00           O  
HETATM   17  C10 UNL     1      -1.806  -0.205  -4.460  1.00  0.00           C  
HETATM   18  N2  UNL     1      -1.186   1.092  -4.561  1.00  0.00           N  
HETATM   19  C11 UNL     1      -3.293  -0.091  -4.139  1.00  0.00           C  
HETATM   20  C12 UNL     1      -3.635  -0.905  -2.921  1.00  0.00           C  
HETATM   21  N3  UNL     1      -5.027  -0.781  -2.548  1.00  0.00           N  
HETATM   22  C13 UNL     1      -2.714  -0.443  -1.808  1.00  0.00           C  
HETATM   23  O7  UNL     1      -3.243  -0.811  -0.566  1.00  0.00           O  
HETATM   24  C14 UNL     1      -3.633   0.299   0.174  1.00  0.00           C  
HETATM   25  O8  UNL     1      -5.035   0.392   0.238  1.00  0.00           O  
HETATM   26  C15 UNL     1      -5.618  -0.401   1.183  1.00  0.00           C  
HETATM   27  C16 UNL     1      -7.134  -0.223   1.020  1.00  0.00           C  
HETATM   28  N4  UNL     1      -7.561  -0.617  -0.296  1.00  0.00           N  
HETATM   29  C17 UNL     1      -5.238   0.004   2.592  1.00  0.00           C  
HETATM   30  O9  UNL     1      -5.018  -1.090   3.420  1.00  0.00           O  
HETATM   31  C18 UNL     1      -4.032   0.922   2.562  1.00  0.00           C  
HETATM   32  O10 UNL     1      -4.372   2.234   2.339  1.00  0.00           O  
HETATM   33  C19 UNL     1      -3.016   0.414   1.521  1.00  0.00           C  
HETATM   34  N5  UNL     1      -2.461  -0.848   2.026  1.00  0.00           N  
HETATM   35  C20 UNL     1       1.843  -0.575  -0.810  1.00  0.00           C  
HETATM   36  O11 UNL     1       2.454  -1.815  -0.624  1.00  0.00           O  
HETATM   37  C21 UNL     1       5.697   0.330  -0.575  1.00  0.00           C  
HETATM   38  N6  UNL     1       5.145   0.171  -1.896  1.00  0.00           N  
HETATM   39  C22 UNL     1       6.359  -0.909  -0.072  1.00  0.00           C  
HETATM   40  O12 UNL     1       7.556  -1.070  -0.800  1.00  0.00           O  
HETATM   41  C23 UNL     1       6.749  -0.680   1.372  1.00  0.00           C  
HETATM   42  O13 UNL     1       6.041  -1.528   2.213  1.00  0.00           O  
HETATM   43  H1  UNL     1       7.523   2.798   3.152  1.00  0.00           H  
HETATM   44  H2  UNL     1       5.870   2.663   3.320  1.00  0.00           H  
HETATM   45  H3  UNL     1       7.999   0.632   3.330  1.00  0.00           H  
HETATM   46  H4  UNL     1       6.315   0.184   3.874  1.00  0.00           H  
HETATM   47  H5  UNL     1       7.275   1.389   1.226  1.00  0.00           H  
HETATM   48  H6  UNL     1       4.238   1.770  -0.050  1.00  0.00           H  
HETATM   49  H7  UNL     1       2.402   1.359  -0.162  1.00  0.00           H  
HETATM   50  H8  UNL     1       1.571  -0.633   2.022  1.00  0.00           H  
HETATM   51  H9  UNL     1       0.970   2.324   1.465  1.00  0.00           H  
HETATM   52  H10 UNL     1       2.145   1.699   2.753  1.00  0.00           H  
HETATM   53  H11 UNL     1      -0.017   2.142   3.555  1.00  0.00           H  
HETATM   54  H12 UNL     1       0.126  -1.673  -0.331  1.00  0.00           H  
HETATM   55  H13 UNL     1      -1.307  -2.011  -1.642  1.00  0.00           H  
HETATM   56  H14 UNL     1       0.004  -0.942  -3.688  1.00  0.00           H  
HETATM   57  H15 UNL     1      -0.554  -3.005  -3.833  1.00  0.00           H  
HETATM   58  H16 UNL     1      -1.767  -0.634  -5.484  1.00  0.00           H  
HETATM   59  H17 UNL     1      -0.510   1.293  -3.800  1.00  0.00           H  
HETATM   60  H18 UNL     1      -1.864   1.862  -4.731  1.00  0.00           H  
HETATM   61  H19 UNL     1      -3.548   0.967  -3.928  1.00  0.00           H  
HETATM   62  H20 UNL     1      -3.934  -0.451  -4.968  1.00  0.00           H  
HETATM   63  H21 UNL     1      -3.420  -1.963  -3.129  1.00  0.00           H  
HETATM   64  H22 UNL     1      -5.543  -1.564  -3.007  1.00  0.00           H  
HETATM   65  H23 UNL     1      -5.383   0.096  -2.999  1.00  0.00           H  
HETATM   66  H24 UNL     1      -2.750   0.665  -1.848  1.00  0.00           H  
HETATM   67  H25 UNL     1      -3.357   1.231  -0.412  1.00  0.00           H  
HETATM   68  H26 UNL     1      -5.382  -1.454   1.026  1.00  0.00           H  
HETATM   69  H27 UNL     1      -7.379   0.856   1.148  1.00  0.00           H  
HETATM   70  H28 UNL     1      -7.666  -0.822   1.793  1.00  0.00           H  
HETATM   71  H29 UNL     1      -7.372   0.151  -0.985  1.00  0.00           H  
HETATM   72  H30 UNL     1      -7.158  -1.526  -0.613  1.00  0.00           H  
HETATM   73  H31 UNL     1      -6.067   0.602   3.026  1.00  0.00           H  
HETATM   74  H32 UNL     1      -5.423  -0.936   4.290  1.00  0.00           H  
HETATM   75  H33 UNL     1      -3.533   0.847   3.544  1.00  0.00           H  
HETATM   76  H34 UNL     1      -5.341   2.423   2.448  1.00  0.00           H  
HETATM   77  H35 UNL     1      -2.181   1.153   1.582  1.00  0.00           H  
HETATM   78  H36 UNL     1      -3.218  -1.547   2.003  1.00  0.00           H  
HETATM   79  H37 UNL     1      -2.164  -0.620   3.022  1.00  0.00           H  
HETATM   80  H38 UNL     1       2.094  -0.245  -1.828  1.00  0.00           H  
HETATM   81  H39 UNL     1       1.773  -2.404  -0.194  1.00  0.00           H  
HETATM   82  H40 UNL     1       6.477   1.132  -0.640  1.00  0.00           H  
HETATM   83  H41 UNL     1       5.915  -0.024  -2.559  1.00  0.00           H  
HETATM   84  H42 UNL     1       4.714   1.074  -2.183  1.00  0.00           H  
HETATM   85  H43 UNL     1       5.723  -1.811  -0.186  1.00  0.00           H  
HETATM   86  H44 UNL     1       7.536  -1.899  -1.327  1.00  0.00           H  
HETATM   87  H45 UNL     1       7.841  -0.887   1.541  1.00  0.00           H  
HETATM   88  H46 UNL     1       5.271  -1.088   2.654  1.00  0.00           H  
CONECT    1    2   43   44
CONECT    2    3   45   46
CONECT    3    4   41   47
CONECT    4    5
CONECT    5    6   37   48
CONECT    6    7
CONECT    7    8   35   49
CONECT    8    9   11   50
CONECT    9   10   51   52
CONECT   10   53
CONECT   11   12
CONECT   12   13   35   54
CONECT   13   14
CONECT   14   15   22   55
CONECT   15   16   17   56
CONECT   16   57
CONECT   17   18   19   58
CONECT   18   59   60
CONECT   19   20   61   62
CONECT   20   21   22   63
CONECT   21   64   65
CONECT   22   23   66
CONECT   23   24
CONECT   24   25   33   67
CONECT   25   26
CONECT   26   27   29   68
CONECT   27   28   69   70
CONECT   28   71   72
CONECT   29   30   31   73
CONECT   30   74
CONECT   31   32   33   75
CONECT   32   76
CONECT   33   34   77
CONECT   34   78   79
CONECT   35   36   80
CONECT   36   81
CONECT   37   38   39   82
CONECT   38   83   84
CONECT   39   40   41   85
CONECT   40   86
CONECT   41   42   87
CONECT   42   88
END

HMDB0015129
     RDKit          3D
Neomycin
 88 91  0  0  0  0  0  0  0  0999 V2000
    6.7688    2.2645    3.6521 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9019    0.8719    3.2446 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5269    0.7604    1.7685 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.2299    1.1803    1.6035 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6541    0.8242    0.4066 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.6604   -0.1008    0.6369 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3990    0.3450    0.2572 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3671    0.2163    1.3314 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2510    1.5039    2.1589 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1786    1.3427    3.0406 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1691    0.0772    0.6641 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3730   -0.6051   -0.5135 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.4401   -0.1374   -1.4824 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3472   -0.9774   -2.0804 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.1071   -1.1501   -3.5487 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3471   -2.4537   -3.9725 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8063   -0.2054   -4.4602 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.1861    1.0918   -4.5611 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2934   -0.0913   -4.1388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6355   -0.9047   -2.9209 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.0266   -0.7810   -2.5476 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7142   -0.4434   -1.8084 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.2429   -0.8115   -0.5655 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6330    0.2992    0.1736 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.0347    0.3919    0.2384 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6181   -0.4007    1.1829 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.1337   -0.2229    1.0203 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5606   -0.6172   -0.2961 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2385    0.0038    2.5917 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.0184   -1.0896    3.4198 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0316    0.9222    2.5620 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.3720    2.2343    2.3390 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0162    0.4138    1.5214 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4614   -0.8475    2.0262 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8426   -0.5746   -0.8098 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4536   -1.8151   -0.6245 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6972    0.3303   -0.5750 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1453    0.1708   -1.8962 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3588   -0.9094   -0.0721 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.5560   -1.0697   -0.7999 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7491   -0.6805    1.3717 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0411   -1.5276    2.2134 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5233    2.7982    3.1517 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8695    2.6632    3.3197 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9986    0.6321    3.3302 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3148    0.1844    3.8742 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    1.3890    1.2263 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2383    1.7696   -0.0500 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4019    1.3588   -0.1618 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5708   -0.6332    2.0216 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9696    2.3240    1.4646 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1450    1.6988    2.7525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0168    2.1421    3.5554 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1257   -1.6730   -0.3309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3070   -2.0108   -1.6415 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0040   -0.9422   -3.6885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5539   -3.0045   -3.8329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7669   -0.6342   -5.4843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5102    1.2932   -3.7997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8636    1.8623   -4.7312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5483    0.9673   -3.9277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9342   -0.4513   -4.9681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4204   -1.9633   -3.1292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5425   -1.5639   -3.0067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3833    0.0958   -2.9988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7498    0.6647   -1.8479 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3575    1.2311   -0.4120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3820   -1.4536    1.0264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3794    0.8558    1.1483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6661   -0.8222    1.7934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3723    0.1512   -0.9850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1581   -1.5260   -0.6131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0670    0.6019    3.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4232   -0.9360    4.2900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5330    0.8470    3.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3406    2.4234    2.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1810    1.1526    1.5825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2181   -1.5469    2.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1638   -0.6204    3.0221 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0942   -0.2449   -1.8280 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7729   -2.4041   -0.1941 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4770    1.1315   -0.6395 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9153   -0.0239   -2.5586 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7142    1.0739   -2.1834 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7228   -1.8114   -0.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5364   -1.8990   -1.3271 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8407   -0.8866    1.5413 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2705   -1.0881    2.6542 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 26 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 12 35  1  0
 35 36  1  0
  5 37  1  0
 37 38  1  0
 37 39  1  0
 39 40  1  0
 39 41  1  0
 41 42  1  0
 41  3  1  0
 35  7  1  0
 22 14  1  0
 33 24  1  0
  1 43  1  0
  1 44  1  0
  2 45  1  0
  2 46  1  0
  3 47  1  6
  5 48  1  6
  7 49  1  6
  8 50  1  1
  9 51  1  0
  9 52  1  0
 10 53  1  0
 12 54  1  1
 14 55  1  1
 15 56  1  1
 16 57  1  0
 17 58  1  6
 18 59  1  0
 18 60  1  0
 19 61  1  0
 19 62  1  0
 20 63  1  6
 21 64  1  0
 21 65  1  0
 22 66  1  1
 24 67  1  6
 26 68  1  6
 27 69  1  0
 27 70  1  0
 28 71  1  0
 28 72  1  0
 29 73  1  1
 30 74  1  0
 31 75  1  1
 32 76  1  0
 33 77  1  6
 34 78  1  0
 34 79  1  0
 35 80  1  6
 36 81  1  0
 37 82  1  6
 38 83  1  0
 38 84  1  0
 39 85  1  1
 40 86  1  0
 41 87  1  6
 42 88  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Fradiomycin b	ChEBI
Framicetina	ChEBI
Framycetine	ChEBI
Framycetinum	ChEBI
Neomycin b	ChEBI
Framycetin	Kegg
FRM	Kegg
Caswell no. 595	HMDB
Neomycin b sulfate	HMDB
Neomycin sulfate	HMDB
Neomycin sulphate	HMDB
USAF CB-19	HMDB
Fradiomycin sulfate	HMDB
Neomycin palmitate	HMDB
Palmitate, neomycin	HMDB
Sulfate, neomycin	HMDB
Sulfate, fradiomycin	HMDB
Antibiotic 10676	HMDB
Sulfate, framycetin	HMDB
Soframycin	HMDB
Sulfate, neomycin b	HMDB
Framycetin sulfate	HMDB

Chemical Formula

C₂₃H₄₆N₆O₁₃

Average Molecular Weight

614.6437

Monoisotopic Molecular Weight

614.312285588

IUPAC Name

(2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3S,4R,5S)-5-{[(1R,2R,3S,5R,6S)-3,5-diamino-2-{[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}-6-hydroxycyclohexyl]oxy}-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}oxane-3,4-diol

Traditional Name

neomycin

CAS Registry Number

1404-04-2

SMILES

NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O

InChI Identifier

InChI=1S/C23H46N6O13/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22/h5-23,30-36H,1-4,24-29H2/t5-,6+,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1

InChI Key

PGBHMTALBVVCIT-VCIWKGPPSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 4,5-disubstituted 2-deoxystreptamines. These are 2-deoxystreptamine aminoglycosides that are glycosidically linked to a pyranose of furanose unit at the C4- and C5-positions.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

4,5-disubstituted 2-deoxystreptamines

Alternative Parents

Substituents

4,5-disubstituted 2-deoxystreptamine
Disaccharide
Glycosyl compound
O-glycosyl compound
Aminocyclitol or derivatives
Cyclohexanol
Cyclohexylamine
Cyclitol or derivatives
Oxane
Tetrahydrofuran
Cyclic alcohol
Secondary alcohol
1,2-aminoalcohol
Acetal
Organoheterocyclic compound
Oxacycle
Primary alcohol
Hydrocarbon derivative
Organopnictogen compound
Primary aliphatic amine
Organonitrogen compound
Organic nitrogen compound
Amine
Alcohol
Primary amine
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

aminoglycoside (CHEBI:7508 )
2-Deoxystreptamines (C01737 )

Ontology

Physiological effect

Not Available

Disposition

Biological location

Non-excretory biofluid

Biofluid or Excreta

Blood (PMID: 21059682)

Excreta

Biofluid or Excreta

Urine (PMID: 21059682)

Cellular substructure

Cytoplasm (HMDB: HMDB0015129)
Membrane (HMDB: HMDB0015129)

Source

Exogenous

Exogenous (HMDB: HMDB0015129)

Process

Naturally occurring process

Biological process

Biochemical pathway

Drug action pathway

Neomycin Pathway (HMDB: HMDB0015129)
Neomycin Action Pathway (PathBank: SMP0000256)

Role

Not Available

Physical Properties

State

Liquid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	6 °C (sulfate form)	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	64.7 g/L	Not Available
LogP	-7.8	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	64.7 g/L	ALOGPS
logP	-2.8	ALOGPS
logP	-8.4	ChemAxon
logS	-0.98	ALOGPS
pKa (Strongest Acidic)	12.29	ChemAxon
pKa (Strongest Basic)	9.97	ChemAxon
Physiological Charge	6	ChemAxon
Hydrogen Acceptor Count	19	ChemAxon
Hydrogen Donor Count	13	ChemAxon
Polar Surface Area	353.11 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	135.9 m³·mol⁻¹	ChemAxon
Polarizability	60.87 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	236.994	30932474
DeepCCS	[M-H]-	235.238	30932474
DeepCCS	[M-2H]-	269.271	30932474
DeepCCS	[M+Na]+	243.205	30932474
AllCCS	[M+H]+	235.4	32859911
AllCCS	[M+H-H2O]+	234.7	32859911
AllCCS	[M+NH4]+	236.1	32859911
AllCCS	[M+Na]+	236.3	32859911
AllCCS	[M-H]-	207.2	32859911
AllCCS	[M+Na-2H]-	207.6	32859911
AllCCS	[M+HCOO]-	208.3	32859911

Predicted Retention Times

Underivatized

Chromatographic Method	Retention Time	Reference
Measured using a Waters Acquity ultraperformance liquid chromatography (UPLC) ethylene-bridged hybrid (BEH) C18 column (100 mm × 2.1 mm; 1.7 μmparticle diameter)). Predicted by Afia on May 17, 2022.	1.08 minutes	32390414
Predicted by Siyang on May 30, 2022	12.3064 minutes	33406817
Predicted by Siyang using ReTip algorithm on June 8, 2022	9.25 minutes	32390414
AjsUoB = Accucore 150 Amide HILIC with 10mM Ammonium Formate, 0.1% Formic Acid	887.7 seconds	40023050
Fem_Long = Waters ACQUITY UPLC HSS T3 C18 with Water:MeOH and 0.1% Formic Acid	482.5 seconds	40023050
Fem_Lipids = Ascentis Express C18 with (60:40 water:ACN):(90:10 IPA:ACN) and 10mM NH4COOH + 0.1% Formic Acid	326.6 seconds	40023050
Life_Old = Waters ACQUITY UPLC BEH C18 with Water:(20:80 acetone:ACN) and 0.1% Formic Acid	10.6 seconds	40023050
Life_New = RP Waters ACQUITY UPLC HSS T3 C18 with Water:(30:70 MeOH:ACN) and 0.1% Formic Acid	232.8 seconds	40023050
RIKEN = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	140.7 seconds	40023050
Eawag_XBridgeC18 = XBridge C18 3.5u 2.1x50 mm with Water:MeOH and 0.1% Formic Acid	498.4 seconds	40023050
BfG_NTS_RP1 =Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) with Water:ACN and 0.1% Formic Acid	351.5 seconds	40023050
HILIC_BDD_2 = Merck SeQuant ZIC-HILIC with ACN(0.1% formic acid):water(16 mM ammonium formate)	1962.4 seconds	40023050
UniToyama_Atlantis = RP Waters Atlantis T3 (2.1 x 150 mm, 5 um) with ACN:Water and 0.1% Formic Acid	711.4 seconds	40023050
BDD_C18 = Hypersil Gold 1.9µm C18 with Water:ACN and 0.1% Formic Acid	84.5 seconds	40023050
UFZ_Phenomenex = Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex with Water:MeOH and 0.1% Formic Acid	793.2 seconds	40023050
SNU_RIKEN_POS = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	281.1 seconds	40023050
RPMMFDA = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	580.3 seconds	40023050
MTBLS87 = Merck SeQuant ZIC-pHILIC column with ACN:Water and :ammonium carbonate	1655.2 seconds	40023050
KI_GIAR_zic_HILIC_pH2_7 = Merck SeQuant ZIC-HILIC with ACN:Water and 0.1% FA	1589.8 seconds	40023050
Meister zic-pHILIC pH9.3 = Merck SeQuant ZIC-pHILIC column with ACN:Water 5mM NH4Ac pH9.3 and 5mM ammonium acetate in water	856.7 seconds	40023050

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Neomycin	NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	3323.8	Standard polar	33892256
Neomycin	NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5498.9	Standard non polar	33892256
Neomycin	NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5349.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Neomycin,1TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5134.0	Semi standard non polar	33892256
Neomycin,1TMS,isomer #10	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5170.8	Semi standard non polar	33892256
Neomycin,1TMS,isomer #11	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5190.4	Semi standard non polar	33892256
Neomycin,1TMS,isomer #12	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5164.6	Semi standard non polar	33892256
Neomycin,1TMS,isomer #13	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5164.3	Semi standard non polar	33892256
Neomycin,1TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5101.3	Semi standard non polar	33892256
Neomycin,1TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	5098.5	Semi standard non polar	33892256
Neomycin,1TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@H]1O	5089.8	Semi standard non polar	33892256
Neomycin,1TMS,isomer #5	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5118.7	Semi standard non polar	33892256
Neomycin,1TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@@H]1N	5092.7	Semi standard non polar	33892256
Neomycin,1TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	5098.7	Semi standard non polar	33892256
Neomycin,1TMS,isomer #8	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5191.0	Semi standard non polar	33892256
Neomycin,1TMS,isomer #9	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5179.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4989.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #10	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5057.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #11	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5065.5	Semi standard non polar	33892256
Neomycin,2TMS,isomer #12	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5056.1	Semi standard non polar	33892256
Neomycin,2TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4959.5	Semi standard non polar	33892256
Neomycin,2TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4961.1	Semi standard non polar	33892256
Neomycin,2TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4983.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4960.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #17	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@@H](N)C[C@H]1N	4954.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #18	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5031.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #19	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5030.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4980.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #20	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5030.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #21	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5032.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #22	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5066.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #23	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C	5071.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #24	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	4961.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	4957.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@H]1O	4977.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #27	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O[Si](C)(C)C	4954.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #28	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	5044.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #29	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	5046.1	Semi standard non polar	33892256
Neomycin,2TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4978.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #30	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5068.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #31	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5025.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #32	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5023.7	Semi standard non polar	33892256
Neomycin,2TMS,isomer #33	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	5028.5	Semi standard non polar	33892256
Neomycin,2TMS,isomer #34	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	4954.7	Semi standard non polar	33892256
Neomycin,2TMS,isomer #35	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@@H]1N	4953.7	Semi standard non polar	33892256
Neomycin,2TMS,isomer #36	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4974.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #37	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	5024.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #38	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	5038.5	Semi standard non polar	33892256
Neomycin,2TMS,isomer #39	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5061.5	Semi standard non polar	33892256
Neomycin,2TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4999.3	Semi standard non polar	33892256
Neomycin,2TMS,isomer #40	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5018.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #41	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5017.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #42	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	5018.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #43	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@H]1O	4977.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #44	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4978.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #45	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O	5095.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #46	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5074.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #47	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	5044.7	Semi standard non polar	33892256
Neomycin,2TMS,isomer #48	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)O[C@H](CN)[C@@H](O)[C@@H]1O	5045.3	Semi standard non polar	33892256
Neomycin,2TMS,isomer #49	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	5044.7	Semi standard non polar	33892256
Neomycin,2TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4981.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #50	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O	5041.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #51	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O[Si](C)(C)C	4956.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #52	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	5022.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #53	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O	5063.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #54	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5042.1	Semi standard non polar	33892256
Neomycin,2TMS,isomer #55	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5022.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #56	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5023.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #57	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	5025.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #58	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	5045.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #59	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5069.7	Semi standard non polar	33892256
Neomycin,2TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4982.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #60	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5046.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #61	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5026.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #62	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5026.0	Semi standard non polar	33892256
Neomycin,2TMS,isomer #63	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	5026.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #64	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5149.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #65	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5127.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #66	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5123.5	Semi standard non polar	33892256
Neomycin,2TMS,isomer #67	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5103.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #68	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	5092.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #69	C[Si](C)(C)N(C[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O)[Si](C)(C)C	5264.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #7	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5100.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #70	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5152.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #71	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5149.5	Semi standard non polar	33892256
Neomycin,2TMS,isomer #72	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5146.3	Semi standard non polar	33892256
Neomycin,2TMS,isomer #73	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O	5145.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #74	C[Si](C)(C)N([C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O)[Si](C)(C)C	5145.3	Semi standard non polar	33892256
Neomycin,2TMS,isomer #75	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5123.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #76	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5127.4	Semi standard non polar	33892256
Neomycin,2TMS,isomer #77	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	5120.3	Semi standard non polar	33892256
Neomycin,2TMS,isomer #78	C[Si](C)(C)N([C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N)[Si](C)(C)C	5121.9	Semi standard non polar	33892256
Neomycin,2TMS,isomer #79	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5101.3	Semi standard non polar	33892256
Neomycin,2TMS,isomer #8	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5077.6	Semi standard non polar	33892256
Neomycin,2TMS,isomer #80	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	5095.1	Semi standard non polar	33892256
Neomycin,2TMS,isomer #81	C[Si](C)(C)N(C[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O)[Si](C)(C)C	5264.1	Semi standard non polar	33892256
Neomycin,2TMS,isomer #82	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5096.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #83	C[Si](C)(C)N([C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O)[Si](C)(C)C	5150.8	Semi standard non polar	33892256
Neomycin,2TMS,isomer #84	C[Si](C)(C)N([C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O)[Si](C)(C)C	5148.2	Semi standard non polar	33892256
Neomycin,2TMS,isomer #9	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5065.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4837.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #10	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4901.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #100	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2N)[C@@H](N)C[C@H]1N	4823.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #101	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4882.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #102	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4895.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #103	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4896.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #104	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4897.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #105	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4902.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #106	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C	4910.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #107	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4882.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #108	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4893.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #109	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4883.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #11	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4905.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #110	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4893.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #111	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4899.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #112	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C	4904.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #113	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4971.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #114	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4967.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #115	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4946.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #116	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4946.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #117	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4937.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #118	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5136.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #119	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O[Si](C)(C)C	4987.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4828.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #120	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4980.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #121	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4943.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #122	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4957.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #123	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5011.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #124	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4967.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #125	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4970.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #126	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4939.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #127	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5135.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #128	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	4979.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #129	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C	4989.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4831.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #130	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N([Si](C)(C)C)[Si](C)(C)C)[C@@H](N)C[C@H]1N	5018.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #131	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5011.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #132	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@H]1N	4987.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #133	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N([Si](C)(C)C)[Si](C)(C)C	5015.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #134	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	4814.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #135	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@H]1O	4828.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #136	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	4817.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #137	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4889.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #138	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4917.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #139	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4891.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4832.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #140	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4889.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #141	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4889.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #142	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4888.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #143	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@H]1O	4838.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #144	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@@H]1N	4817.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #145	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4895.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #146	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4886.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #147	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O	4913.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #148	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4881.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #149	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4886.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4839.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #150	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4890.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #151	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4831.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #152	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4900.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #153	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4906.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #154	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O	4933.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #155	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4884.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #156	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O	4894.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #157	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4899.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #158	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4885.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #159	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1N	4889.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #16	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4933.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #160	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4916.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #161	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4873.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #162	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4885.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #163	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4885.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #164	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4964.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #165	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4988.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #166	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4949.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #167	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4944.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #168	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4947.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #169	C[Si](C)(C)O[C@@H]1[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	5142.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #17	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4906.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #170	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	5005.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #171	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4951.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #172	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4960.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #173	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N[Si](C)(C)C	4970.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #174	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	4975.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #175	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5000.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #176	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4977.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #177	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O	4991.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #178	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	4978.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #179	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4943.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #18	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4911.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #180	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4928.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #181	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	5123.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #182	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4953.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #183	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O)[C@H](N)[C@H]1O	5003.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #184	C[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]1O	5001.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #185	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@H]1O	4834.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #186	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O[Si](C)(C)C	4817.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #187	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4892.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #188	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4911.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #189	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4886.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #19	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4903.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #190	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4877.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #191	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4883.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #192	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4888.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #193	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4847.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #194	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4883.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #195	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O	4910.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #196	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4883.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #197	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4883.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #198	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4886.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #199	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4886.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4843.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #20	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4895.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #200	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O	4935.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #201	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4907.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #202	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4887.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #203	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)O[C@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4898.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #204	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4887.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #205	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O	4896.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #206	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N[Si](C)(C)C	4967.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #207	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4993.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #208	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4938.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #209	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N[Si](C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4947.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #21	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4899.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #210	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4936.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #211	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1N([Si](C)(C)C)[Si](C)(C)C	5020.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #212	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	5000.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #213	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4947.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #214	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4959.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #215	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4950.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #216	C[Si](C)(C)O[C@@H]1[C@@H](N)[C@@H](O[C@@H]2[C@@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@H]1O	4964.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #217	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4979.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #218	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4976.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #219	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O	4989.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #22	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4841.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #220	C[Si](C)(C)O[C@@H]1[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@H]1O	4974.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #221	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4938.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #222	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4929.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #223	C[Si](C)(C)O[C@@H]1[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@H]1O	5122.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #224	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4936.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #225	C[Si](C)(C)O[C@@H]1[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O)O[C@H](CN)[C@H]1O	4996.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #226	C[Si](C)(C)O[C@@H]1[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@H]1O	5122.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #227	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1N	4835.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #228	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4901.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #229	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O	4933.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #23	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4837.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #230	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4906.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #231	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4884.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #232	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)O[C@H](CN)[C@@H](O)[C@@H]1O	4895.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #233	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4898.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #234	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O	4938.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #235	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4910.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #236	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4890.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #237	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O[Si](C)(C)C)O[C@H](CN)[C@@H](O)[C@@H]1O	4900.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #238	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4892.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #239	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4901.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #24	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4847.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #240	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5028.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #241	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4989.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #242	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O	5006.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #243	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4989.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #244	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1O	5002.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #245	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5008.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #246	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4965.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #247	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4975.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #248	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4965.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #249	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	4976.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #25	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4933.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #250	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5006.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #251	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4944.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #252	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4936.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #253	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4934.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #254	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5148.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #255	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4938.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #256	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O	4947.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #257	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N([Si](C)(C)C)[Si](C)(C)C)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5029.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #258	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4934.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #259	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1N	5150.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #26	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4907.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #260	C[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N([Si](C)(C)C)[Si](C)(C)C	5027.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #261	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4887.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #262	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O	4918.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #263	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4890.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #264	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4877.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #265	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	4887.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #266	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4888.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #267	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4981.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #268	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4952.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #269	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4941.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #27	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4898.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #270	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4941.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #271	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4938.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #272	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN([Si](C)(C)C)[Si](C)(C)C)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@@H]1N	5125.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #273	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5002.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #274	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4979.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #275	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O	4993.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #276	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O	4994.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #277	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@@H]1N	4977.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #278	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4968.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #279	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4949.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #28	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4904.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #280	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	4961.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #281	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@@H]1N	4968.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #282	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4939.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #283	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4934.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #284	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@@H]1N	5122.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #285	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N[Si](C)(C)C)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	4950.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #286	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@@H]2O)[C@@H]1N	5005.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #287	C[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@@H]1N([Si](C)(C)C)[Si](C)(C)C	5013.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #288	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4989.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #289	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4964.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #29	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4900.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #290	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4949.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #291	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4947.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #292	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4946.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #293	C[Si](C)(C)O[C@@H]1[C@H](CN([Si](C)(C)C)[Si](C)(C)C)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	5142.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #294	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5007.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #295	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4978.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #296	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4994.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #297	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O	4998.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #298	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	4979.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #299	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4970.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4827.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #30	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4903.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #300	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4952.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #301	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	4961.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #302	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	4975.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #303	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4941.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #304	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4931.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #305	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	5121.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #306	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4953.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #307	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@H]1O	5011.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #308	C[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]1O	4994.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #309	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5077.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #31	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4830.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #310	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5056.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #311	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5062.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #312	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	5048.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #313	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5231.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #314	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5074.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #315	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5028.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #316	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5030.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #317	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	5019.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #318	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5208.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #319	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5062.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #32	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4844.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #320	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4995.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #321	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4992.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #322	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5213.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #323	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5212.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #324	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4989.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #325	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5191.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #326	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5092.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #327	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@@H]1O	5191.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #328	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@@H]1O	5085.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #329	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5089.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #33	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O	4951.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #330	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5077.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #331	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	5089.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #332	C[Si](C)(C)N[C@@H]1C[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5103.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #333	C[Si](C)(C)N[C@H]1C[C@@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5103.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #334	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5059.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #335	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	5051.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #336	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5231.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #337	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5073.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #338	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O	5071.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #339	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5061.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #34	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4919.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #340	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N([Si](C)(C)C)[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5123.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #341	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5059.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #342	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O)[C@H]1O	5117.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #343	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5028.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #344	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	5039.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #345	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5050.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #346	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5098.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #347	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	5022.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #348	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1N	5207.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #349	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5062.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #35	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4897.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #350	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5050.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #351	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N([Si](C)(C)C)[Si](C)(C)C	5102.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #352	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4989.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #353	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5188.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #354	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5084.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #355	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@@H]1O	5192.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #356	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@@H]1O	5092.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #357	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5067.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #358	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5072.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #36	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)O[C@H](CN)[C@@H](O)[C@@H]1O	4903.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #37	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4897.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #38	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O	4900.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #39	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1N	4832.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1N	4837.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #40	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	4933.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #41	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4906.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #42	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4896.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #43	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	4901.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #44	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4912.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #45	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4903.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #46	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O	4935.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #47	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4909.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #48	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4903.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #49	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	4906.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1N	4846.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #50	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4902.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #51	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4905.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #52	C[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5022.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #53	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5003.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #54	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5011.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #55	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5003.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #56	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H]1O	5009.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #57	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N([Si](C)(C)C)[Si](C)(C)C)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5003.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #58	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4974.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #59	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4982.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #6	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C	4925.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #60	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4975.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #61	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C	4981.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #62	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N([Si](C)(C)C)[Si](C)(C)C)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4997.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #63	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4966.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #64	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4957.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #65	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4955.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #66	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5156.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #67	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4960.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #68	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	4965.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #69	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N([Si](C)(C)C)[Si](C)(C)C)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5029.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #7	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4919.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #70	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C)[C@@H](O)[C@@H]1O	4952.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #71	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1N	5157.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #72	C[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N([Si](C)(C)C)[Si](C)(C)C	5024.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #73	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4824.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #74	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4833.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #75	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4824.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #76	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@@H](N)C[C@H]1N	4827.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #77	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C	4896.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #78	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@@H]1O	4897.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #79	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4881.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #8	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4900.3	Semi standard non polar	33892256
Neomycin,3TMS,isomer #80	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	4895.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #81	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4902.9	Semi standard non polar	33892256
Neomycin,3TMS,isomer #82	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C	4910.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #83	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4845.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #84	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4831.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #85	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@@H](N)C[C@H]1N	4831.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #86	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C)[C@@H]1O	4888.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #87	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C	4895.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #88	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	4886.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #89	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	4898.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #9	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	4906.7	Semi standard non polar	33892256
Neomycin,3TMS,isomer #90	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4902.4	Semi standard non polar	33892256
Neomycin,3TMS,isomer #91	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C	4909.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #92	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	4834.1	Semi standard non polar	33892256
Neomycin,3TMS,isomer #93	C[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2N)[C@@H](N)C[C@H]1N	4842.8	Semi standard non polar	33892256
Neomycin,3TMS,isomer #94	C[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4893.0	Semi standard non polar	33892256
Neomycin,3TMS,isomer #95	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O	4907.5	Semi standard non polar	33892256
Neomycin,3TMS,isomer #96	C[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	4892.2	Semi standard non polar	33892256
Neomycin,3TMS,isomer #97	C[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)O[C@H](CN)[C@@H](O)[C@@H]1O	4907.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #98	C[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	4924.6	Semi standard non polar	33892256
Neomycin,3TMS,isomer #99	C[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4932.4	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5335.3	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5398.4	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5420.2	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5400.3	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5397.5	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5318.9	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	5312.1	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@H]1O	5304.8	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5328.1	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@@H]1N	5306.3	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	5312.4	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5419.8	Semi standard non polar	33892256
Neomycin,1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5410.2	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5352.7	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5411.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO[Si](C)(C)C(C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5449.7	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO[Si](C)(C)C(C)(C)C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5408.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5298.2	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5294.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5328.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1N	5298.9	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2N)[C@@H](N)C[C@H]1N	5290.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5410.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5376.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5341.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5408.9	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5377.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5390.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O[Si](C)(C)C(C)(C)C	5403.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	5285.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O	5275.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](N)[C@H]1O	5317.0	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CN)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O[Si](C)(C)C(C)(C)C	5295.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	5410.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1N	5365.0	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5330.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5386.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5396.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5357.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	5368.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O	5273.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@@H]2O)[C@@H]1N	5270.0	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5307.9	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	5356.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1N	5357.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5378.7	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5367.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #40	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5389.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5351.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #42	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	5397.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #43	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](N)[C@H]1O	5316.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #44	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)O[C@H](CO)[C@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1N	5308.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1O	5417.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C(C)(C)C)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5397.0	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #47	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	5421.9	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@H](CN)[C@@H](O)[C@@H]1O	5386.9	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #49	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](N)[C@@H](O)[C@@H]1O	5421.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1N	5340.9	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O[Si](C)(C)C(C)(C)C)O[C@@H](CN)[C@@H](O)[C@@H]1O	5382.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #51	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](CN)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@H]1O[Si](C)(C)C(C)(C)C	5296.0	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #52	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	5399.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #53	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@H]2O)[C@H]1O	5379.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #54	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5358.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #55	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5392.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #56	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5354.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #57	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	5352.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #58	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	5410.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #59	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5386.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](N)C[C@H](N)[C@H]2O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1N	5332.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #60	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5365.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #61	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5396.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #62	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O	5360.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #63	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	5366.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #64	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N[Si](C)(C)C(C)(C)C)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5501.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #65	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N[Si](C)(C)C(C)(C)C)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5484.1	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #66	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5513.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #67	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5480.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #68	CC(C)(C)[Si](C)(C)NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	5468.0	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #69	CC(C)(C)[Si](C)(C)N(C[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O)[Si](C)(C)C(C)(C)C	5620.2	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5435.8	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #70	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5480.2	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #71	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5502.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #72	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O	5478.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #73	CC(C)(C)[Si](C)(C)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1O	5478.2	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #74	CC(C)(C)[Si](C)(C)N([C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H]1O)[Si](C)(C)C(C)(C)C	5539.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #75	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C(C)(C)C)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5456.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #76	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N[Si](C)(C)C(C)(C)C)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5483.2	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #77	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N[Si](C)(C)C(C)(C)C	5448.4	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #78	CC(C)(C)[Si](C)(C)N([C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N)[Si](C)(C)C(C)(C)C	5513.6	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #79	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5479.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@@H]1O[C@H]1O[C@H](CN)[C@@H](O)[C@H](O)[C@H]1N	5416.2	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #80	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	5470.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #81	CC(C)(C)[Si](C)(C)N(C[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O)[Si](C)(C)C(C)(C)C	5618.7	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #82	CC(C)(C)[Si](C)(C)N[C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N[Si](C)(C)C(C)(C)C)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O	5447.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #83	CC(C)(C)[Si](C)(C)N([C@H]1[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)O[C@H](CN)[C@@H](O)[C@@H]1O)[Si](C)(C)C(C)(C)C	5559.5	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #84	CC(C)(C)[Si](C)(C)N([C@H]1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)O[C@@H](CN)[C@@H](O)[C@@H]1O)[Si](C)(C)C(C)(C)C	5552.3	Semi standard non polar	33892256
Neomycin,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O	5449.7	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (Non-derivatized) - 70eV, Positive	splash10-001i-7141290000-1d118bea988327c31f82	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (1 TMS) - 70eV, Positive	splash10-001i-9341105000-267bc688fe9cf91d65e8	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_10) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_11) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_12) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_1_13) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Neomycin GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 10V, Positive-QTOF	splash10-059t-0119482000-ffdc0e43566451df2770	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 20V, Positive-QTOF	splash10-08mr-0928720000-996bb8f7855d3e85b860	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 40V, Positive-QTOF	splash10-074j-4926000000-c31af30f83e2c83c73c8	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 10V, Negative-QTOF	splash10-03ki-6015593000-b65aa1924d1108bbb4b5	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 20V, Negative-QTOF	splash10-0fep-8628790000-7f5b87306932c4896d5f	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 40V, Negative-QTOF	splash10-0fn9-3849010000-bab816a750f8a64740c6	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 10V, Positive-QTOF	splash10-014l-0800339000-6b946842d215c555103f	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 20V, Positive-QTOF	splash10-01ox-0900211000-595172ae6408734c4e48	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 40V, Positive-QTOF	splash10-01ox-9511450000-c93dbeb27c933d5b5c00	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 10V, Negative-QTOF	splash10-03di-0201219000-3f9668d26af13f0bfc8f	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 20V, Negative-QTOF	splash10-03di-4424298000-6320ecb92950f4012b9e	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Neomycin 40V, Negative-QTOF	splash10-0fkc-4796600000-b980bdc4fed06048f4a4	2021-10-11	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm

Biospecimen Locations

Blood
Urine

Tissue Locations

Not Available

Pathways

Name	SMPDB/PathBank	KEGG
Neomycin Action Pathway		Not Available

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Taking drug identified by DrugBank entry DB00994	21059682	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Taking drug identified by DrugBank entry DB00994	21059682	details

Abnormal Concentrations

Not Available

Predicted Concentrations

Biospecimen	Value	Original age	Original sex	Original condition	Comments
Blood	0.000 uM	Adult (>18 years old)	Both	Normal	Predicted based on drug qualities
Blood	0.000 umol/mmol creatinine	Adult (>18 years old)	Both	Normal	Predicted based on drug qualities

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

DB00452

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Not Available

Wikipedia Link

Neomycin

METLIN ID

Not Available

PubChem Compound

8378

PDB ID

Not Available

ChEBI ID

7508

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Not Available

Showing metabocard for Neomycin (HMDB0015129)

MOL for HMDB0015129 (Neomycin)

3D MOL for HMDB0015129 (Neomycin)

3D SDF for HMDB0015129 (Neomycin)

3D-SDF for HMDB0015129 (Neomycin)

PDB for HMDB0015129 (Neomycin)

3D PDB for HMDB0015129 (Neomycin)

SMILES for HMDB0015129 (Neomycin)

INCHI for HMDB0015129 (Neomycin)

Structure for HMDB0015129 (Neomycin)

3D Structure for HMDB0015129 (Neomycin)

Predicted Collision Cross Sections

Predicted Retention Times

Underivatized

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra