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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (3) Show 3 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2013-05-09 20:52:09 UTC

Update Date

2022-03-07 03:17:38 UTC

HMDB ID

HMDB0060067

Secondary Accession Numbers

HMDB60067

Metabolite Identification

Common Name

CMP-2-aminoethylphosphonate

Description

CMP-2-aminoethylphosphonate, also known as cmpciliatine, belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups. CMP-2-aminoethylphosphonate is a very strong basic compound (based on its pKa). These are pyrimidine ribobucleotides with diphosphate group linked to the ribose moiety.

Structure

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


  Mrv0541 05091313522D          

 27 28  0  0  0  0            999 V2000
    1.7044   -3.4197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0717    2.8941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1893   -2.7523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2871    2.6392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2032   -0.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4186   -0.5465    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8839   -3.3335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7512   -0.0616    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0837   -0.5465    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3387   -1.3312    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0333   -1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2432    3.7011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3990   -4.0009    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5484   -2.5798    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8538   -1.9986    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7512    0.7634    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2991   -0.2916    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6977   -1.1587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3086    2.0038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9225    1.6607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9044    1.5549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4143   -0.0143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3748    0.5154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1637   -1.3312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9440    1.0253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1155    1.8322    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    5.1594    0.7703    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  6  5  1  1  0  0  0
  7  1  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 12  2  1  0  0  0  0
 13  7  2  0  0  0  0
 14  7  1  0  0  0  0
 14 11  2  0  0  0  0
 15  3  1  0  0  0  0
 10 15  1  1  0  0  0
 15 11  1  0  0  0  0
  8 16  1  6  0  0  0
  9 17  1  6  0  0  0
 18 11  1  0  0  0  0
 23  5  1  0  0  0  0
 24  6  1  0  0  0  0
 24 10  1  0  0  0  0
 26  4  1  0  0  0  0
 26 19  1  0  0  0  0
 26 20  2  0  0  0  0
 26 25  1  0  0  0  0
 27 21  1  0  0  0  0
 27 22  2  0  0  0  0
 27 23  1  0  0  0  0
 27 25  1  0  0  0  0
M  END

HMDB0060067
     RDKit          3D
CMP-2-aminoethylphosphonate
 47 48  0  0  0  0  0  0  0  0999 V2000
   -7.6222    1.5718   -2.1768 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5889    1.2794   -1.4204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3817    1.9210   -1.6021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3156    1.5804   -0.7795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4225    0.6538    0.1791 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3419    0.2753    1.0489 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2063    0.9929    0.6827 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1132    0.2422    1.1050 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1366    0.5867    0.3198 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1601   -0.2085    0.8126 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6285    0.0411    0.0535 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.2640    1.2756    0.6963 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5026    0.3440   -1.5836 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6370   -1.2630    0.4113 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8713   -1.4636   -0.6919 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.4480   -1.2306   -2.1167 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4016   -3.0829   -0.5793 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2886   -0.4182   -0.2830 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3158    0.7209   -1.2965 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4164    1.5995   -1.0400 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -1.1673    0.7238 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8178   -2.1187    1.4866 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9792   -1.1839    0.9505 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.2291   -1.7735    2.1808 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6152    0.0594    0.3158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7643   -0.9022    1.2944 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6746    0.3549   -0.4550 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5269    1.1036   -2.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2901    2.6766   -2.3819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3753    2.0843   -0.9255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5588    0.5673    2.1128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8944    0.3606    2.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3712    1.6702    0.3582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0439    0.2510   -0.7378 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2511   -0.4128   -2.1346 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2757   -3.2194   -0.9776 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1243   -0.0141    0.7355 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2380   -0.9828   -0.2799 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4257    0.2641   -2.3007 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3203    1.2099   -1.2251 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0301    1.6693   -1.8813 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0568    2.5233   -0.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3036   -1.2819   -0.3585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0917   -2.4739    0.8920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4703   -1.6982    0.1156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1605   -1.1202    2.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8760   -1.8635    0.9944 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  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
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 15 18  1  0
 18 19  1  0
 19 20  1  0
  8 21  1  0
 21 22  1  0
 21 23  1  0
 23 24  1  0
  5 25  1  0
 25 26  1  0
 25 27  2  0
 27  2  1  0
 23  6  1  0
  1 28  1  0
  3 29  1  0
  4 30  1  0
  6 31  1  1
  8 32  1  1
  9 33  1  0
  9 34  1  0
 13 35  1  0
 17 36  1  0
 18 37  1  0
 18 38  1  0
 19 39  1  0
 19 40  1  0
 20 41  1  0
 20 42  1  0
 21 43  1  6
 22 44  1  0
 23 45  1  6
 24 46  1  0
 26 47  1  0
M  END


  Mrv0541 05091313522D          

 27 28  0  0  0  0            999 V2000
    1.7044   -3.4197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0717    2.8941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1893   -2.7523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2871    2.6392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2032   -0.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4186   -0.5465    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8839   -3.3335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7512   -0.0616    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0837   -0.5465    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3387   -1.3312    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0333   -1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2432    3.7011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3990   -4.0009    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5484   -2.5798    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8538   -1.9986    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7512    0.7634    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2991   -0.2916    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6977   -1.1587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3086    2.0038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9225    1.6607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9044    1.5549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4143   -0.0143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3748    0.5154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1637   -1.3312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9440    1.0253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1155    1.8322    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    5.1594    0.7703    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  6  5  1  1  0  0  0
  7  1  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 12  2  1  0  0  0  0
 13  7  2  0  0  0  0
 14  7  1  0  0  0  0
 14 11  2  0  0  0  0
 15  3  1  0  0  0  0
 10 15  1  1  0  0  0
 15 11  1  0  0  0  0
  8 16  1  6  0  0  0
  9 17  1  6  0  0  0
 18 11  1  0  0  0  0
 23  5  1  0  0  0  0
 24  6  1  0  0  0  0
 24 10  1  0  0  0  0
 26  4  1  0  0  0  0
 26 19  1  0  0  0  0
 26 20  2  0  0  0  0
 26 25  1  0  0  0  0
 27 21  1  0  0  0  0
 27 22  2  0  0  0  0
 27 23  1  0  0  0  0
 27 25  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0060067

> <DATABASE_NAME>
hmdb

> <SMILES>
NCCP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=N)N=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C11H20N4O10P2/c12-2-4-26(19,20)25-27(21,22)23-5-6-8(16)9(17)10(24-6)15-3-1-7(13)14-11(15)18/h1,3,6,8-10,16-17H,2,4-5,12H2,(H,19,20)(H,21,22)(H2,13,14,18)/t6-,8-,9-,10-/m1/s1

> <INCHI_KEY>
FBADRUOBFLBKJQ-PEBGCTIMSA-N

> <FORMULA>
C11H20N4O10P2

> <MOLECULAR_WEIGHT>
430.2448

> <EXACT_MASS>
430.065465904

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
35.968124949571845

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2-aminoethyl)[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphinic acid

> <ALOGPS_LOGP>
-2.16

> <JCHEM_LOGP>
-3.7602390089721136

> <ALOGPS_LOGS>
-1.61

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
3.3353464642264585

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.6655595337733438

> <JCHEM_PKA_STRONGEST_BASIC>
11.002910703067927

> <JCHEM_POLAR_SURFACE_AREA>
228.44999999999996

> <JCHEM_REFRACTIVITY>
98.30279999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.05e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
cmpciliatine

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0060067
     RDKit          3D
CMP-2-aminoethylphosphonate
 47 48  0  0  0  0  0  0  0  0999 V2000
   -7.6222    1.5718   -2.1768 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5889    1.2794   -1.4204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3817    1.9210   -1.6021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3156    1.5804   -0.7795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4225    0.6538    0.1791 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3419    0.2753    1.0489 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2063    0.9929    0.6827 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1132    0.2422    1.1050 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1366    0.5867    0.3198 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1601   -0.2085    0.8126 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6285    0.0411    0.0535 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.2640    1.2756    0.6963 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5026    0.3440   -1.5836 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6370   -1.2630    0.4113 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8713   -1.4636   -0.6919 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.4480   -1.2306   -2.1167 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4016   -3.0829   -0.5793 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2886   -0.4182   -0.2830 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3158    0.7209   -1.2965 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4164    1.5995   -1.0400 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -1.1673    0.7238 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8178   -2.1187    1.4866 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9792   -1.1839    0.9505 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.2291   -1.7735    2.1808 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6152    0.0594    0.3158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7643   -0.9022    1.2944 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6746    0.3549   -0.4550 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5269    1.1036   -2.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2901    2.6766   -2.3819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3753    2.0843   -0.9255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5588    0.5673    2.1128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8944    0.3606    2.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3712    1.6702    0.3582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0439    0.2510   -0.7378 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2511   -0.4128   -2.1346 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2757   -3.2194   -0.9776 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1243   -0.0141    0.7355 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2380   -0.9828   -0.2799 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4257    0.2641   -2.3007 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3203    1.2099   -1.2251 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0301    1.6693   -1.8813 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0568    2.5233   -0.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3036   -1.2819   -0.3585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0917   -2.4739    0.8920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4703   -1.6982    0.1156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1605   -1.1202    2.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8760   -1.8635    0.9944 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  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
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 15 18  1  0
 18 19  1  0
 19 20  1  0
  8 21  1  0
 21 22  1  0
 21 23  1  0
 23 24  1  0
  5 25  1  0
 25 26  1  0
 25 27  2  0
 27  2  1  0
 23  6  1  0
  1 28  1  0
  3 29  1  0
  4 30  1  0
  6 31  1  1
  8 32  1  1
  9 33  1  0
  9 34  1  0
 13 35  1  0
 17 36  1  0
 18 37  1  0
 18 38  1  0
 19 39  1  0
 19 40  1  0
 20 41  1  0
 20 42  1  0
 21 43  1  6
 22 44  1  0
 23 45  1  6
 24 46  1  0
 26 47  1  0
M  END

HEADER    PROTEIN                                 09-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   09-MAY-13         0                                  
HETATM    1  C   UNK     0       3.182  -6.383   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      13.201   5.402   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       4.087  -5.138   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      11.736   4.927   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       7.846  -0.544   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       6.381  -1.020   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.650  -6.223   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       5.136  -0.115   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       3.890  -1.020   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       4.366  -2.485   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       1.929  -3.570   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0      13.521   6.909   0.000  0.00  0.00           N+0
HETATM   13  N   UNK     0       0.745  -7.468   0.000  0.00  0.00           N+0
HETATM   14  N   UNK     0       1.024  -4.816   0.000  0.00  0.00           N+0
HETATM   15  N   UNK     0       3.460  -3.731   0.000  0.00  0.00           N+0
HETATM   16  O   UNK     0       5.136   1.425   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0       2.425  -0.544   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       1.302  -2.163   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0       9.909   3.740   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0      12.922   3.100   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0       9.155   2.902   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      10.107  -0.027   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       8.166   0.962   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       5.906  -2.485   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0      11.095   1.914   0.000  0.00  0.00           O+0
HETATM   26  P   UNK     0      11.416   3.420   0.000  0.00  0.00           P+0
HETATM   27  P   UNK     0       9.631   1.438   0.000  0.00  0.00           P+0
CONECT    1    3    7                                                       
CONECT    2    4   12                                                       
CONECT    3    1   15                                                       
CONECT    4    2   26                                                       
CONECT    5    6   23                                                       
CONECT    6    5    8   24                                                  
CONECT    7    1   13   14                                                  
CONECT    8    6    9   16                                                  
CONECT    9    8   10   17                                                  
CONECT   10    9   15   24                                                  
CONECT   11   14   15   18                                                  
CONECT   12    2                                                            
CONECT   13    7                                                            
CONECT   14    7   11                                                       
CONECT   15    3   10   11                                                  
CONECT   16    8                                                            
CONECT   17    9                                                            
CONECT   18   11                                                            
CONECT   19   26                                                            
CONECT   20   26                                                            
CONECT   21   27                                                            
CONECT   22   27                                                            
CONECT   23    5   27                                                       
CONECT   24    6   10                                                       
CONECT   25   26   27                                                       
CONECT   26    4   19   20   25                                             
CONECT   27   21   22   23   25                                             
MASTER        0    0    0    0    0    0    0    0   27    0   56    0
END

COMPND    HMDB0060067
HETATM    1  N1  UNL     1      -7.622   1.572  -2.177  1.00  0.00           N  
HETATM    2  C1  UNL     1      -6.589   1.279  -1.420  1.00  0.00           C  
HETATM    3  C2  UNL     1      -5.382   1.921  -1.602  1.00  0.00           C  
HETATM    4  C3  UNL     1      -4.316   1.580  -0.780  1.00  0.00           C  
HETATM    5  N2  UNL     1      -4.422   0.654   0.179  1.00  0.00           N  
HETATM    6  C4  UNL     1      -3.342   0.275   1.049  1.00  0.00           C  
HETATM    7  O1  UNL     1      -2.206   0.993   0.683  1.00  0.00           O  
HETATM    8  C5  UNL     1      -1.113   0.242   1.105  1.00  0.00           C  
HETATM    9  C6  UNL     1       0.137   0.587   0.320  1.00  0.00           C  
HETATM   10  O2  UNL     1       1.160  -0.208   0.813  1.00  0.00           O  
HETATM   11  P1  UNL     1       2.629   0.041   0.054  1.00  0.00           P  
HETATM   12  O3  UNL     1       3.264   1.276   0.696  1.00  0.00           O  
HETATM   13  O4  UNL     1       2.503   0.344  -1.584  1.00  0.00           O  
HETATM   14  O5  UNL     1       3.637  -1.263   0.411  1.00  0.00           O  
HETATM   15  P2  UNL     1       4.871  -1.464  -0.692  1.00  0.00           P  
HETATM   16  O6  UNL     1       4.448  -1.231  -2.117  1.00  0.00           O  
HETATM   17  O7  UNL     1       5.402  -3.083  -0.579  1.00  0.00           O  
HETATM   18  C7  UNL     1       6.289  -0.418  -0.283  1.00  0.00           C  
HETATM   19  C8  UNL     1       6.316   0.721  -1.297  1.00  0.00           C  
HETATM   20  N3  UNL     1       7.416   1.600  -1.040  1.00  0.00           N  
HETATM   21  C9  UNL     1      -1.500  -1.167   0.724  1.00  0.00           C  
HETATM   22  O8  UNL     1      -0.818  -2.119   1.487  1.00  0.00           O  
HETATM   23  C10 UNL     1      -2.979  -1.184   0.950  1.00  0.00           C  
HETATM   24  O9  UNL     1      -3.229  -1.773   2.181  1.00  0.00           O  
HETATM   25  C11 UNL     1      -5.615   0.059   0.316  1.00  0.00           C  
HETATM   26  O10 UNL     1      -5.764  -0.902   1.294  1.00  0.00           O  
HETATM   27  N4  UNL     1      -6.675   0.355  -0.455  1.00  0.00           N  
HETATM   28  H1  UNL     1      -8.527   1.104  -2.054  1.00  0.00           H  
HETATM   29  H2  UNL     1      -5.290   2.677  -2.382  1.00  0.00           H  
HETATM   30  H3  UNL     1      -3.375   2.084  -0.926  1.00  0.00           H  
HETATM   31  H4  UNL     1      -3.559   0.567   2.113  1.00  0.00           H  
HETATM   32  H5  UNL     1      -0.894   0.361   2.170  1.00  0.00           H  
HETATM   33  H6  UNL     1       0.371   1.670   0.358  1.00  0.00           H  
HETATM   34  H7  UNL     1      -0.044   0.251  -0.738  1.00  0.00           H  
HETATM   35  H8  UNL     1       2.251  -0.413  -2.135  1.00  0.00           H  
HETATM   36  H9  UNL     1       6.276  -3.219  -0.978  1.00  0.00           H  
HETATM   37  H10 UNL     1       6.124  -0.014   0.735  1.00  0.00           H  
HETATM   38  H11 UNL     1       7.238  -0.983  -0.280  1.00  0.00           H  
HETATM   39  H12 UNL     1       6.426   0.264  -2.301  1.00  0.00           H  
HETATM   40  H13 UNL     1       5.320   1.210  -1.225  1.00  0.00           H  
HETATM   41  H14 UNL     1       8.030   1.669  -1.881  1.00  0.00           H  
HETATM   42  H15 UNL     1       7.057   2.523  -0.752  1.00  0.00           H  
HETATM   43  H16 UNL     1      -1.304  -1.282  -0.359  1.00  0.00           H  
HETATM   44  H17 UNL     1      -0.092  -2.474   0.892  1.00  0.00           H  
HETATM   45  H18 UNL     1      -3.470  -1.698   0.116  1.00  0.00           H  
HETATM   46  H19 UNL     1      -3.161  -1.120   2.922  1.00  0.00           H  
HETATM   47  H20 UNL     1      -5.876  -1.864   0.994  1.00  0.00           H  
CONECT    1    2    2   28
CONECT    2    3   27
CONECT    3    4    4   29
CONECT    4    5   30
CONECT    5    6   25
CONECT    6    7   23   31
CONECT    7    8
CONECT    8    9   21   32
CONECT    9   10   33   34
CONECT   10   11
CONECT   11   12   12   13   14
CONECT   13   35
CONECT   14   15
CONECT   15   16   16   17   18
CONECT   17   36
CONECT   18   19   37   38
CONECT   19   20   39   40
CONECT   20   41   42
CONECT   21   22   23   43
CONECT   22   44
CONECT   23   24   45
CONECT   24   46
CONECT   25   26   27   27
CONECT   26   47
END

HMDB0060067
     RDKit          3D
CMP-2-aminoethylphosphonate
 47 48  0  0  0  0  0  0  0  0999 V2000
   -7.6222    1.5718   -2.1768 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5889    1.2794   -1.4204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3817    1.9210   -1.6021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3156    1.5804   -0.7795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4225    0.6538    0.1791 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3419    0.2753    1.0489 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2063    0.9929    0.6827 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1132    0.2422    1.1050 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1366    0.5867    0.3198 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1601   -0.2085    0.8126 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6285    0.0411    0.0535 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.2640    1.2756    0.6963 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5026    0.3440   -1.5836 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6370   -1.2630    0.4113 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8713   -1.4636   -0.6919 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.4480   -1.2306   -2.1167 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4016   -3.0829   -0.5793 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2886   -0.4182   -0.2830 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3158    0.7209   -1.2965 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4164    1.5995   -1.0400 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -1.1673    0.7238 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8178   -2.1187    1.4866 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9792   -1.1839    0.9505 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.2291   -1.7735    2.1808 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6152    0.0594    0.3158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7643   -0.9022    1.2944 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6746    0.3549   -0.4550 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5269    1.1036   -2.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2901    2.6766   -2.3819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3753    2.0843   -0.9255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5588    0.5673    2.1128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8944    0.3606    2.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3712    1.6702    0.3582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0439    0.2510   -0.7378 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2511   -0.4128   -2.1346 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2757   -3.2194   -0.9776 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1243   -0.0141    0.7355 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2380   -0.9828   -0.2799 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4257    0.2641   -2.3007 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3203    1.2099   -1.2251 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0301    1.6693   -1.8813 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0568    2.5233   -0.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3036   -1.2819   -0.3585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0917   -2.4739    0.8920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4703   -1.6982    0.1156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1605   -1.1202    2.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8760   -1.8635    0.9944 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  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
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 15 18  1  0
 18 19  1  0
 19 20  1  0
  8 21  1  0
 21 22  1  0
 21 23  1  0
 23 24  1  0
  5 25  1  0
 25 26  1  0
 25 27  2  0
 27  2  1  0
 23  6  1  0
  1 28  1  0
  3 29  1  0
  4 30  1  0
  6 31  1  1
  8 32  1  1
  9 33  1  0
  9 34  1  0
 13 35  1  0
 17 36  1  0
 18 37  1  0
 18 38  1  0
 19 39  1  0
 19 40  1  0
 20 41  1  0
 20 42  1  0
 21 43  1  6
 22 44  1  0
 23 45  1  6
 24 46  1  0
 26 47  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
CMPciliatine	Kegg
CMP-2-Aminoethylphosphonic acid	Generator

Chemical Formula

C₁₁H₂₀N₄O₁₀P₂

Average Molecular Weight

430.2448

Monoisotopic Molecular Weight

430.065465904

IUPAC Name

(2-aminoethyl)[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphinic acid

Traditional Name

cmpciliatine

CAS Registry Number

Not Available

SMILES

NCCP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=N)N=C1O

InChI Identifier

InChI=1S/C11H20N4O10P2/c12-2-4-26(19,20)25-27(21,22)23-5-6-8(16)9(17)10(24-6)15-3-1-7(13)14-11(15)18/h1,3,6,8-10,16-17H,2,4-5,12H2,(H,19,20)(H,21,22)(H2,13,14,18)/t6-,8-,9-,10-/m1/s1

InChI Key

FBADRUOBFLBKJQ-PEBGCTIMSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Pentose phosphates

Alternative Parents

Substituents

Pentose phosphate
Pentose-5-phosphate
Glycosyl compound
N-glycosyl compound
Monosaccharide phosphate
Aminopyrimidine
Pyrimidone
Monoalkyl phosphate
Hydropyrimidine
Organic phosphoric acid derivative
Phosphoric acid ester
Pyrimidine
Alkyl phosphate
Imidolactam
Tetrahydrofuran
Organophosphonic acid
Organophosphonic acid derivative
Heteroaromatic compound
1,2-diol
Secondary alcohol
Organoheterocyclic compound
Azacycle
Oxacycle
Organopnictogen compound
Organophosphorus compound
Organonitrogen compound
Alcohol
Hydrocarbon derivative
Primary aliphatic amine
Organic oxide
Amine
Primary amine
Organic nitrogen compound
Aromatic heteromonocyclic compound

Molecular Framework

Aromatic heteromonocyclic compounds

External Descriptors

nucleotide 2-aminoethylphosphonate (CHEBI:3276 )

Ontology

Not Available

Exogenous (HMDB: HMDB0060067)

Process

Not Available

Role

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	10.5 g/L	ALOGPS
logP	-2.2	ALOGPS
logP	-3.8	ChemAxon
logS	-1.6	ALOGPS
pKa (Strongest Acidic)	1.67	ChemAxon
pKa (Strongest Basic)	11	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	228.45 Å²	ChemAxon
Rotatable Bond Count	8	ChemAxon
Refractivity	98.3 m³·mol⁻¹	ChemAxon
Polarizability	35.97 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	196.985	31661259
DarkChem	[M-H]-	191.352	31661259
DeepCCS	[M+H]+	171.884	30932474
DeepCCS	[M-H]-	169.652	30932474
DeepCCS	[M-2H]-	202.89	30932474
DeepCCS	[M+Na]+	177.738	30932474
AllCCS	[M+H]+	188.5	32859911
AllCCS	[M+H-H2O]+	186.3	32859911
AllCCS	[M+NH4]+	190.6	32859911
AllCCS	[M+Na]+	191.2	32859911
AllCCS	[M-H]-	184.5	32859911
AllCCS	[M+Na-2H]-	184.7	32859911
AllCCS	[M+HCOO]-	185.0	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. Predicted by Afia on May 17, 2022.	2.24 minutes	32390414
Predicted by Siyang on May 30, 2022	10.1507 minutes	33406817
Predicted by Siyang using ReTip algorithm on June 8, 2022	9.6 minutes	32390414
Fem_Long = Waters ACQUITY UPLC HSS T3 C18 with Water:MeOH and 0.1% Formic Acid	407.4 seconds	40023050
Fem_Lipids = Ascentis Express C18 with (60:40 water:ACN):(90:10 IPA:ACN) and 10mM NH4COOH + 0.1% Formic Acid	274.7 seconds	40023050
Life_Old = Waters ACQUITY UPLC BEH C18 with Water:(20:80 acetone:ACN) and 0.1% Formic Acid	18.9 seconds	40023050
Life_New = RP Waters ACQUITY UPLC HSS T3 C18 with Water:(30:70 MeOH:ACN) and 0.1% Formic Acid	179.1 seconds	40023050
RIKEN = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	86.5 seconds	40023050
Eawag_XBridgeC18 = XBridge C18 3.5u 2.1x50 mm with Water:MeOH and 0.1% Formic Acid	351.6 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	260.6 seconds	40023050
HILIC_BDD_2 = Merck SeQuant ZIC-HILIC with ACN(0.1% formic acid):water(16 mM ammonium formate)	1102.3 seconds	40023050
UniToyama_Atlantis = RP Waters Atlantis T3 (2.1 x 150 mm, 5 um) with ACN:Water and 0.1% Formic Acid	568.2 seconds	40023050
BDD_C18 = Hypersil Gold 1.9µm C18 with Water:ACN and 0.1% Formic Acid	54.1 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	624.4 seconds	40023050
SNU_RIKEN_POS = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	186.8 seconds	40023050
RPMMFDA = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	408.6 seconds	40023050
MTBLS87 = Merck SeQuant ZIC-pHILIC column with ACN:Water and :ammonium carbonate	1032.4 seconds	40023050
KI_GIAR_zic_HILIC_pH2_7 = Merck SeQuant ZIC-HILIC with ACN:Water and 0.1% FA	942.8 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	626.0 seconds	40023050

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
CMP-2-aminoethylphosphonate	NCCP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=N)N=C1O	4998.6	Standard polar	33892256
CMP-2-aminoethylphosphonate	NCCP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=N)N=C1O	2986.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate	NCCP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=N)N=C1O	3809.8	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
CMP-2-aminoethylphosphonate,1TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)CCN)O[C@H]1N1C=CC(=N)N=C1O	3589.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3593.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TMS,isomer #3	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]1O	3542.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TMS,isomer #4	C[Si](C)(C)OP(=O)(CCN)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	3653.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TMS,isomer #5	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)OP(=O)(O)CCN	3653.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TMS,isomer #6	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	3695.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O)=N1	3581.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3489.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #10	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C	3598.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3451.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #12	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]1O	3512.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #13	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]1O	3508.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #14	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O	3568.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #15	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3460.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #16	C[Si](C)(C)OP(=O)(CCN)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3592.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #17	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	3639.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3524.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #19	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3648.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #2	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]1O[Si](C)(C)C	3466.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O)=N1	3519.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #21	C[Si](C)(C)N(CCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)[Si](C)(C)C	3776.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #22	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3587.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)O[C@H]1N1C=CC(=N)N=C1O	3552.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3555.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #5	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O	3595.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #6	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3456.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #7	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]1O	3472.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3557.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3560.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #1	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3393.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3506.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #11	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	3541.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #12	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3408.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #13	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O	3533.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3404.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3640.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3466.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]1O	3436.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #18	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3433.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #19	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C	3481.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3461.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3364.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3514.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #22	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3545.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #23	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3408.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #24	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C	3538.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #25	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3403.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3649.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #27	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3463.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #28	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]1O	3469.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #29	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3523.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3462.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #30	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3398.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #31	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O	3507.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #32	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3392.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #33	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O	3652.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #34	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3467.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #35	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3587.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #36	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3452.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #37	C[Si](C)(C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	3716.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #38	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3500.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #39	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C	3719.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #4	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3495.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #40	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3510.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #41	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3657.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #5	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3365.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #6	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]1O[Si](C)(C)C	3428.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #7	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3428.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #8	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O	3474.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3364.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #1	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3387.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #1	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3059.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #1	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	6005.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3568.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3347.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	5348.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3409.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3442.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	5378.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #12	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3413.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #12	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3084.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #12	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	5796.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #13	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	3457.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #13	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	3199.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #13	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	5289.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3362.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3284.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5951.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #15	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O	3440.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #15	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O	3191.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #15	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O	5244.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3351.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3264.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5884.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3561.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3345.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	5555.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3400.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3415.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5502.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #19	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	3512.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #19	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	3234.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #19	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	4748.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #2	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3385.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #2	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3037.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #2	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5944.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3398.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3339.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	5652.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3621.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3383.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	5074.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #22	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3443.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #22	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3478.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #22	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	5133.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3612.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3383.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	5073.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #24	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3426.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #24	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3478.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #24	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	5088.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #25	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3553.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #25	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3637.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #25	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	5428.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #26	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3421.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #26	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3074.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #26	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	5780.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #27	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3464.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #27	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3188.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #27	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	5262.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #28	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3370.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #28	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3279.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #28	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	5935.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #29	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C	3446.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #29	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C	3179.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #29	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C	5228.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #3	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3424.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #3	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3164.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #3	C[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	5521.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #30	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3359.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #30	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3259.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #30	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	5866.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #31	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3570.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #31	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3334.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #31	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	5540.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #32	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3409.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #32	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3411.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #32	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	5486.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #33	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3517.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #33	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3215.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #33	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	4721.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #34	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3404.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #34	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3321.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #34	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	5639.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #35	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3628.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #35	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3364.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #35	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	5050.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #36	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3448.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #36	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3461.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #36	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	5110.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #37	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3617.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #37	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3365.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #37	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	5060.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #38	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3430.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #38	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3462.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #38	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	5074.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #39	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3553.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #39	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3623.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #39	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	5415.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #4	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3320.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #4	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3248.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #4	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	6075.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #40	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3475.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #40	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3264.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #40	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C	4990.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #41	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3379.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #41	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3325.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #41	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	5772.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #42	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O	3617.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #42	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O	3394.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #42	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O	5313.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #43	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3434.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #43	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3453.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #43	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	5279.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #44	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O	3602.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #44	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O	3396.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #44	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O	5313.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #45	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3413.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #45	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3459.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #45	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	5237.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #46	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3543.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #46	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3622.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #46	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	5568.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #47	C[Si](C)(C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3670.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #47	C[Si](C)(C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3433.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #47	C[Si](C)(C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	4813.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #48	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3454.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #48	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3510.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #48	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4835.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #49	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3573.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #49	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3660.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #49	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	5180.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3459.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3074.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	5648.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #50	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3591.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #50	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3662.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #50	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	5181.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #6	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3484.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #6	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3191.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #6	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	5060.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3367.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3311.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	5870.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #8	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3477.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #8	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3180.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #8	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	5022.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3362.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3289.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	5798.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #1	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3390.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #1	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3029.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #1	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5717.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3574.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3317.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	4781.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3416.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3407.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	4815.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3569.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3318.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	4792.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #13	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3392.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #13	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3404.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #13	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	4784.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3507.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3568.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	5123.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #15	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	3429.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #15	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	3171.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #15	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	4714.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3376.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3231.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5625.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3564.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3315.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	5025.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3412.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3380.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4950.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #19	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3551.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #19	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3318.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #19	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	5021.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #2	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3429.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #2	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3141.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #2	C[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	4996.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3385.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3378.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4909.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #21	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3501.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #21	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3544.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #21	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5249.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3597.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3356.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	4523.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #23	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3430.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #23	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3449.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #23	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	4529.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #24	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3547.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #24	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3602.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #24	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	4862.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #25	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3526.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #25	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3601.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #25	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	4859.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #26	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3439.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #26	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3162.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #26	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	4682.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #27	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3385.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #27	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3228.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #27	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	5606.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #28	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3574.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #28	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3306.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #28	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	4995.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #29	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3423.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #29	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3375.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #29	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	4919.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #3	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3349.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #3	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3216.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #3	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5848.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #30	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3561.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #30	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3309.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #30	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	5003.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #31	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3395.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #31	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3373.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #31	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	4891.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #32	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3511.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #32	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3537.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #32	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	5232.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #33	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3603.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #33	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3339.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #33	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	4497.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #34	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3434.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #34	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3431.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #34	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	4502.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #35	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3552.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #35	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3584.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #35	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	4835.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #36	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3533.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #36	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3585.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #36	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	4846.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #37	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O	3580.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #37	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O	3371.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #37	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O	4776.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #38	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3409.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #38	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3427.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #38	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	4674.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #39	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3543.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #39	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3577.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #39	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	5007.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #4	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3405.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #4	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3131.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #4	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4967.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #40	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3519.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #40	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3577.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #40	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	5003.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #41	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3565.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #41	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3626.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #41	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4613.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #5	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3337.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #5	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3195.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #5	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5758.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #6	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3531.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #6	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3296.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #6	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5283.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3371.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3348.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5198.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #8	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3472.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #8	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3161.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #8	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	4472.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3381.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3257.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,5TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	5544.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #1	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3419.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #1	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3142.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #1	C[Si](C)(C)NCCP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	4469.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #10	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3528.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #10	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3532.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #10	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	4570.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3515.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3534.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #11	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	4581.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #12	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3549.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #12	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3304.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #12	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	4512.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #13	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3414.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #13	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3329.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #13	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4400.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3528.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3500.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #14	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4696.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #15	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3510.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #15	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3505.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #15	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4693.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3542.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	3563.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #16	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(O)=N1	4339.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3566.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3297.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #17	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	4480.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3424.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3328.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #18	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	4367.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #19	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3539.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #19	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3497.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #19	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	4664.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #2	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3380.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #2	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3175.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #2	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	5498.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3521.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	3501.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #20	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O[Si](C)(C)C)=N1	4675.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #21	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3553.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #21	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	3547.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #21	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(O)=N1	4313.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #22	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3540.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #22	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	3541.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #22	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C)=N1	4476.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #3	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3546.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #3	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3277.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #3	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4743.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #4	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3404.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #4	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3302.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #4	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)CCN[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4656.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #5	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3536.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #5	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3276.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #5	C[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4754.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #6	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3380.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #6	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3299.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #6	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4632.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3490.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	3475.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #7	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C)[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=N1	4951.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3580.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	3306.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C	4274.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3423.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	3358.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,6TMS,isomer #9	C[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(CCN[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(O)=N1	4268.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)CCN)O[C@H]1N1C=CC(=N)N=C1O	3836.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3835.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]1O	3792.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OP(=O)(CCN)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	3893.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)OP(=O)(O)CCN	3885.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	3956.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O)=N1	3841.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	3948.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4058.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	3899.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]1O	3977.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	3981.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O	4024.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3892.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(CCN)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4063.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	4121.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3972.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4118.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	3928.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O)=N1	3963.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N(CCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)[Si](C)(C)C(C)(C)C	4181.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4039.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)O[C@H]1N1C=CC(=N)N=C1O	4015.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	4027.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4058.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3911.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	3930.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	4022.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	4031.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4051.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	4144.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4190.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4044.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4189.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4048.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	4274.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4085.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4093.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4099.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4121.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	4114.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3987.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	4157.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4194.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4047.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4194.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4049.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	4273.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4077.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	4111.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4157.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	4114.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4030.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O	4149.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4028.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	4271.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4067.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4230.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4076.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O	4329.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4130.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4337.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	4131.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4140.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4293.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3980.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4082.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4087.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4117.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	3986.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4206.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3677.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	6192.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	4380.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	3930.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	5353.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4163.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3984.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	5405.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4216.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	3654.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5981.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4259.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3783.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)O[Si](C)(C)C(C)(C)C	5320.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	4147.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	3821.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	6127.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4255.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	3773.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	5284.0	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	4149.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	3800.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	6013.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4376.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	3912.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5548.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	4175.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	3934.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	5496.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4300.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3789.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4834.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4208.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3655.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	6088.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4172.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3845.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	5840.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	4420.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3924.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	5117.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4220.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3983.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	5188.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	4410.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	3923.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=N)N=C1O	5113.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4210.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3981.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	5149.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4363.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4141.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	5422.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4231.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	3648.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5964.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4268.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3776.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	5291.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4156.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3817.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	6110.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4261.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	3766.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	5266.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	4228.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3789.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	5534.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4156.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3796.3	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	5997.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4379.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	3904.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5532.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4177.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3930.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	5480.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4312.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3772.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4811.2	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4181.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	3825.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	5825.9	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	4423.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3907.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	5092.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4224.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	3963.6	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	5163.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #37	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	4415.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #37	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	3906.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #37	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O	5101.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4215.6	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	3963.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	5136.4	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4358.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	4121.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(O)=N1	5410.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	4109.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	3826.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=N1	6216.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #40	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4260.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #40	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3796.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #40	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	5059.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4149.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3817.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	5936.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	4398.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	3921.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	5341.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4197.1	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3939.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	5299.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	4384.0	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	3921.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1=NC(=N)C=CN1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	5338.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4186.8	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	3939.4	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	5262.8	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4360.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	4105.2	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O[Si](C)(C)C(C)(C)C)=N1	5532.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4446.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3933.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4884.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4221.4	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	3976.1	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4925.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4393.3	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4130.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	5212.6	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	4255.9	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	3660.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=N)N=C2O)[C@@H]1O[Si](C)(C)C(C)(C)C	5827.3	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4409.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	4133.8	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O)C(O)=N1	5216.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4283.7	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3794.7	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	5108.7	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4147.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3867.9	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)CCN)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	6060.5	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	4278.5	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3781.0	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NCCP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=N)N=C2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	5082.1	Standard polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	4150.2	Semi standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	3844.5	Standard non polar	33892256
CMP-2-aminoethylphosphonate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(CCN)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C(O)=N1	5946.4	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - CMP-2-aminoethylphosphonate GC-MS (Non-derivatized) - 70eV, Positive	splash10-0il0-4491100000-c58be3f963d056d7e503	2017-09-20	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - CMP-2-aminoethylphosphonate GC-MS (3 TMS) - 70eV, Positive	splash10-001i-6962125000-0e0f273a6527b10c3dde	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - CMP-2-aminoethylphosphonate GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - CMP-2-aminoethylphosphonate GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	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 - CMP-2-aminoethylphosphonate 10V, Positive-QTOF	splash10-03di-0900100000-73d6dd2e619136d26646	2017-10-06	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 20V, Positive-QTOF	splash10-03di-2900000000-4f3e70dd0530ba91d8ae	2017-10-06	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 40V, Positive-QTOF	splash10-03di-5900000000-e3b480c6c94bd3015181	2017-10-06	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 10V, Negative-QTOF	splash10-01t9-1916800000-f9700940521d9abaf847	2017-10-06	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 20V, Negative-QTOF	splash10-03di-5912000000-a0d105e032bcba97850c	2017-10-06	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 40V, Negative-QTOF	splash10-0r00-6900000000-37f53b0671f71c3241b1	2017-10-06	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 10V, Positive-QTOF	splash10-001i-0103900000-42efdedf580fe08a3962	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 20V, Positive-QTOF	splash10-03fr-0923300000-b5df5142e3eeb9eb2175	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 40V, Positive-QTOF	splash10-03di-9521000000-c496c4a65bd31efe5b3f	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 10V, Negative-QTOF	splash10-004i-0000900000-ec1e2997d3c208d62442	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 20V, Negative-QTOF	splash10-004i-9003500000-37b9b847359b7a6ab7d4	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - CMP-2-aminoethylphosphonate 40V, Negative-QTOF	splash10-004i-9702000000-0796f1d6dfbdeef544b5	2021-10-12	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

C05673

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

440754

PDB ID

Not Available

ChEBI ID

3276

Food Biomarker Ontology

Not Available

VMH ID

CMP2AMEP

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Thiele I, Swainston N, Fleming RM, Hoppe A, Sahoo S, Aurich MK, Haraldsdottir H, Mo ML, Rolfsson O, Stobbe MD, Thorleifsson SG, Agren R, Bolling C, Bordel S, Chavali AK, Dobson P, Dunn WB, Endler L, Hala D, Hucka M, Hull D, Jameson D, Jamshidi N, Jonsson JJ, Juty N, Keating S, Nookaew I, Le Novere N, Malys N, Mazein A, Papin JA, Price ND, Selkov E Sr, Sigurdsson MI, Simeonidis E, Sonnenschein N, Smallbone K, Sorokin A, van Beek JH, Weichart D, Goryanin I, Nielsen J, Westerhoff HV, Kell DB, Mendes P, Palsson BO: A community-driven global reconstruction of human metabolism. Nat Biotechnol. 2013 May;31(5):419-25. doi: 10.1038/nbt.2488. Epub 2013 Mar 3. [PubMed:23455439 ]

Enzymes

Enzyme Details

1. Ethanolamine-phosphate cytidylyltransferase

General function:: Involved in catalytic activity
Specific function:: Plays an important role in the biosynthesis of the phospholipid phosphatidylethanolamine. Catalyzes the formation of CDP-ethanolamine.
Gene Name:: PCYT2
Uniprot ID:: Q99447
Molecular weight:: 35199.52

Reactions

Cytidine triphosphate + Ciliatine → Pyrophosphate + CMP-2-aminoethylphosphonate	details

Enzyme Details

2. Choline/ethanolaminephosphotransferase 1

General function:: Involved in phosphotransferase activity, for other substituted phosphate groups
Specific function:: Catalyzes both phosphatidylcholine and phosphatidylethanolamine biosynthesis from CDP-choline and CDP-ethanolamine, respectively. Involved in protein-dependent process of phospholipid transport to distribute phosphatidyl choline to the lumenal surface. Has a higher cholinephosphotransferase activity than ethanolaminephosphotransferase activity.
Gene Name:: CEPT1
Uniprot ID:: Q9Y6K0
Molecular weight:: 46553.135

Reactions

CMP-2-aminoethylphosphonate + Diacylglycerol → Cytidine monophosphate + Diacylglyceryl-2-aminoethylphosphonate	details

Enzyme Details

3. Ethanolaminephosphotransferase 1

General function:: Involved in phosphotransferase activity, for other substituted phosphate groups
Specific function:: Catalyzes phosphatidylethanolamine biosynthesis from CDP-ethanolamine. It thereby plays a central role in the formation and maintenance of vesicular membranes. Involved in the formation of phosphatidylethanolamine via 'Kennedy' pathway.
Gene Name:: EPT1
Uniprot ID:: Q9C0D9
Molecular weight:: 45228.42

Reactions

CMP-2-aminoethylphosphonate + Diacylglycerol → Cytidine monophosphate + Diacylglyceryl-2-aminoethylphosphonate	details

Showing metabocard for CMP-2-aminoethylphosphonate (HMDB0060067)

MOL for HMDB0060067 (CMP-2-aminoethylphosphonate)

3D MOL for HMDB0060067 (CMP-2-aminoethylphosphonate)

3D SDF for HMDB0060067 (CMP-2-aminoethylphosphonate)

3D-SDF for HMDB0060067 (CMP-2-aminoethylphosphonate)

PDB for HMDB0060067 (CMP-2-aminoethylphosphonate)

3D PDB for HMDB0060067 (CMP-2-aminoethylphosphonate)

SMILES for HMDB0060067 (CMP-2-aminoethylphosphonate)

INCHI for HMDB0060067 (CMP-2-aminoethylphosphonate)

Structure for HMDB0060067 (CMP-2-aminoethylphosphonate)

3D Structure for HMDB0060067 (CMP-2-aminoethylphosphonate)

Predicted Collision Cross Sections

Predicted Retention Times

Underivatized

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes

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