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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (6) Show 6 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2009-04-06 16:22:37 UTC

Update Date

2021-09-14 15:38:59 UTC

HMDB ID

HMDB0012302

Secondary Accession Numbers

HMDB12302

Metabolite Identification

Common Name

UDP-D-galacturonic acid

Description

UDP-D-galacturonic acid (UDP-GalA), belongs to the class of organic compounds known as pyrimidine nucleotide sugars. These are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group. UDP-D-galacturonic acid is known to be formed by the 4-epimerization of UDP-D-glucuronic acid. UDP-D-galacturonic acid is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, UDP-D-galacturonic acid has been detected, but not quantified in, several different foods, such as peaches, apples, Cucurbita (gourd), agaves, and oats. This could make UDP-D-galacturonic acid a potential biomarker for the consumption of these foods.

Structure

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


  Mrv1652309042000362D          

 37 39  0  0  0  0            999 V2000
 9996.7322 9997.8355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.5234 9997.8273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.0311 9999.6859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5531 9998.4495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.7456 9999.2745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.4604 9999.6859    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
 9994.122310000.9252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.3740 9999.1619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.047910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.872910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.2856 9999.6880    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
10003.0012 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.873110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.698110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.4284 9998.4536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.428410001.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10005.8576 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.144010002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.712810002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.857610000.9272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9995.551810000.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.837310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.8373 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5518 9999.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.2663 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9996.266310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10004.429110000.9259    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10003.714610000.5134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.7146 9999.6883    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10004.4291 9999.2759    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10005.1436 9999.6883    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
10005.143610000.5134    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9997.6453 9999.7683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9996.9779 9999.2833    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9997.2328 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.0578 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.3127 9999.2833    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 21 22  1  0  0  0  0
 21 26  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 24  4  2  0  0  0  0
 22  7  2  0  0  0  0
 27 32  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 12  1  1  0  0  0
 30 15  1  1  0  0  0
 27 16  1  6  0  0  0
 31 17  1  6  0  0  0
 32 20  1  6  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 33 34  1  0  0  0  0
 33 37  1  0  0  0  0
 35  1  1  1  0  0  0
 34 25  1  6  0  0  0
 36  2  1  1  0  0  0
 37  3  1  6  0  0  0
M  END

HMDB0012302
     RDKit          3D
UDP-D-galacturonic acid
 59 61  0  0  0  0  0  0  0  0999 V2000
   -8.6721    0.0934    1.5158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4295    0.1315    1.7298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0172    0.1058    3.0483 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4569    0.2015    0.5842 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.1962    0.2300    1.1298 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1737    0.1248    0.2080 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.1122    1.1616   -0.6928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6631    2.0258   -0.6190 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.6312    2.9563    0.5734 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5868    2.9898   -2.0194 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3189    0.9825   -0.6184 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1799    1.6273    0.4220 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.3132    3.1481    0.3549 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4242    1.1756    2.0214 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4064    1.2076   -0.0085 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2451    1.6932    0.9612 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6987    1.3884    0.7018 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9490    0.0186    0.6321 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3064    0.0254    0.2647 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7998   -1.2943   -0.0054 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7947   -1.8307    0.7225 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3032   -3.0921    0.5033 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7730   -3.8390   -0.5031 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2223   -5.0113   -0.7315 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7767   -3.3138   -1.2392 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3000   -2.0737   -0.9993 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3693   -1.6135   -1.7051 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3711    0.9596   -0.8947 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5232    1.7661   -0.7680 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1365    1.8434   -0.6765 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4876    3.1845   -0.6530 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3058   -1.1697   -0.5568 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.3010   -1.3467   -1.4763 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6337   -1.0872   -1.3181 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.7891   -2.2033   -2.1439 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7205   -1.0149   -0.2692 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.6835   -2.1699    0.5071 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9355    0.9766    3.5372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6927    1.1192    0.0209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2174    0.1195    0.7769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0870    3.8398   -1.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5681    0.1955    2.0474 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1477    2.7688    1.1661 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9820    1.1727    1.9182 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3662    1.8163    1.4595 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8558    0.4503    1.1036 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2146   -1.2397    1.5193 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1164   -3.4878    1.1239 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3941   -3.9222   -2.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3721    0.4907   -1.8787 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4100    2.4475   -0.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3956    1.6065   -1.4392 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5350    3.5718   -1.5483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4104   -1.9849    0.1771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5334   -2.1216   -2.0459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6676   -0.1451   -1.9083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4020   -1.9547   -2.8774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7260   -0.9094   -0.7075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4037   -2.7906    0.2028 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  2  0
 19 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
  6 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36  4  1  0
 30 17  1  0
 26 20  1  0
  3 38  1  0
  4 39  1  6
  6 40  1  1
 10 41  1  0
 14 42  1  0
 16 43  1  0
 16 44  1  0
 17 45  1  1
 19 46  1  1
 21 47  1  0
 22 48  1  0
 25 49  1  0
 28 50  1  6
 29 51  1  0
 30 52  1  6
 31 53  1  0
 32 54  1  1
 33 55  1  0
 34 56  1  6
 35 57  1  0
 36 58  1  6
 37 59  1  0
M  END


  Mrv1652309042000362D          

 37 39  0  0  0  0            999 V2000
 9996.7322 9997.8355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.5234 9997.8273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.0311 9999.6859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5531 9998.4495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.7456 9999.2745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.4604 9999.6859    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
 9994.122310000.9252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.3740 9999.1619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.047910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.872910000.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.2856 9999.6880    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
10003.0012 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.873110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.698110000.4055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.4284 9998.4536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10004.428410001.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10005.8576 9999.2765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.144010002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.712810002.1626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10005.857610000.9272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9995.551810000.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.837310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9994.8373 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9995.5518 9999.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.2663 9999.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9996.266310000.5113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10004.429110000.9259    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10003.714610000.5134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.7146 9999.6883    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10004.4291 9999.2759    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10005.1436 9999.6883    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
10005.143610000.5134    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9997.6453 9999.7683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9996.9779 9999.2833    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9997.2328 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.0578 9998.4987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9998.3127 9999.2833    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 21 22  1  0  0  0  0
 21 26  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 24  4  2  0  0  0  0
 22  7  2  0  0  0  0
 27 32  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 12  1  1  0  0  0
 30 15  1  1  0  0  0
 27 16  1  6  0  0  0
 31 17  1  6  0  0  0
 32 20  1  6  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 33 34  1  0  0  0  0
 33 37  1  0  0  0  0
 35  1  1  1  0  0  0
 34 25  1  6  0  0  0
 36  2  1  1  0  0  0
 37  3  1  6  0  0  0
M  END
> <DATABASE_ID>
HMDB0012302

> <DATABASE_NAME>
hmdb

> <SMILES>
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O

> <INCHI_IDENTIFIER>
InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8-,9-,10-,11+,12-,14-/m1/s1

> <INCHI_KEY>
HDYANYHVCAPMJV-GXNRKQDOSA-N

> <FORMULA>
C15H22N2O18P2

> <MOLECULAR_WEIGHT>
580.2853

> <EXACT_MASS>
580.034284934

> <JCHEM_ACCEPTOR_COUNT>
15

> <JCHEM_ATOM_COUNT>
59

> <JCHEM_AVERAGE_POLARIZABILITY>
46.964385283194744

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S,3R,4S,5R,6R)-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

> <ALOGPS_LOGP>
-1.21

> <JCHEM_LOGP>
-4.676333540666667

> <ALOGPS_LOGS>
-1.51

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-3

> <JCHEM_PKA>
2.9123372974564385

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.716401031397627

> <JCHEM_PKA_STRONGEST_BASIC>
-3.73201272403137

> <JCHEM_POLAR_SURFACE_AREA>
308.60999999999996

> <JCHEM_REFRACTIVITY>
106.32319999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.81e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
udp-galacturonic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0012302
     RDKit          3D
UDP-D-galacturonic acid
 59 61  0  0  0  0  0  0  0  0999 V2000
   -8.6721    0.0934    1.5158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4295    0.1315    1.7298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0172    0.1058    3.0483 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4569    0.2015    0.5842 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.1962    0.2300    1.1298 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1737    0.1248    0.2080 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.1122    1.1616   -0.6928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6631    2.0258   -0.6190 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.6312    2.9563    0.5734 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5868    2.9898   -2.0194 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3189    0.9825   -0.6184 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1799    1.6273    0.4220 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.3132    3.1481    0.3549 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4242    1.1756    2.0214 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4064    1.2076   -0.0085 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2451    1.6932    0.9612 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6987    1.3884    0.7018 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9490    0.0186    0.6321 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3064    0.0254    0.2647 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7998   -1.2943   -0.0054 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7947   -1.8307    0.7225 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3032   -3.0921    0.5033 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7730   -3.8390   -0.5031 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2223   -5.0113   -0.7315 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7767   -3.3138   -1.2392 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3000   -2.0737   -0.9993 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3693   -1.6135   -1.7051 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3711    0.9596   -0.8947 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5232    1.7661   -0.7680 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1365    1.8434   -0.6765 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4876    3.1845   -0.6530 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3058   -1.1697   -0.5568 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.3010   -1.3467   -1.4763 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6337   -1.0872   -1.3181 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.7891   -2.2033   -2.1439 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7205   -1.0149   -0.2692 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.6835   -2.1699    0.5071 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9355    0.9766    3.5372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6927    1.1192    0.0209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2174    0.1195    0.7769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0870    3.8398   -1.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5681    0.1955    2.0474 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1477    2.7688    1.1661 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9820    1.1727    1.9182 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3662    1.8163    1.4595 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8558    0.4503    1.1036 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2146   -1.2397    1.5193 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1164   -3.4878    1.1239 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3941   -3.9222   -2.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3721    0.4907   -1.8787 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4100    2.4475   -0.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3956    1.6065   -1.4392 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5350    3.5718   -1.5483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4104   -1.9849    0.1771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5334   -2.1216   -2.0459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6676   -0.1451   -1.9083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4020   -1.9547   -2.8774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7260   -0.9094   -0.7075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4037   -2.7906    0.2028 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  2  0
 19 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
  6 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36  4  1  0
 30 17  1  0
 26 20  1  0
  3 38  1  0
  4 39  1  6
  6 40  1  1
 10 41  1  0
 14 42  1  0
 16 43  1  0
 16 44  1  0
 17 45  1  1
 19 46  1  1
 21 47  1  0
 22 48  1  0
 25 49  1  0
 28 50  1  6
 29 51  1  0
 30 52  1  6
 31 53  1  0
 32 54  1  1
 33 55  1  0
 34 56  1  6
 35 57  1  0
 36 58  1  6
 37 59  1  0
M  END

HEADER    PROTEIN                                 04-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   04-SEP-20         0                                  
HETATM    1  O   UNK     0    8660.5678662.626   0.000  0.00  0.00           O+0
HETATM    2  O   UNK     0    8663.9108662.611   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0    8664.8588666.080   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0    8658.3668663.772   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0    8666.1928665.312   0.000  0.00  0.00           O+0
HETATM    6  P   UNK     0    8667.5268666.080   0.000  0.00  0.00           P+0
HETATM    7  O   UNK     0    8655.6958668.394   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0    8669.2318665.102   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0    8666.7568667.416   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0    8668.2968667.416   0.000  0.00  0.00           O+0
HETATM   11  P   UNK     0    8670.9338666.084   0.000  0.00  0.00           P+0
HETATM   12  O   UNK     0    8672.2698665.316   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0    8670.1638667.424   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0    8671.7038667.424   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0    8674.9338663.780   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0    8674.9338669.937   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0    8677.6018665.316   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0    8676.2698670.704   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0    8673.5978670.704   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0    8677.6018668.397   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0    8658.3638668.391   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0    8657.0308667.621   0.000  0.00  0.00           C+0
HETATM   23  N   UNK     0    8657.0308666.081   0.000  0.00  0.00           N+0
HETATM   24  C   UNK     0    8658.3638665.311   0.000  0.00  0.00           C+0
HETATM   25  N   UNK     0    8659.6978666.081   0.000  0.00  0.00           N+0
HETATM   26  C   UNK     0    8659.6978667.621   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0    8674.9348668.395   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0    8673.6018667.625   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0    8673.6018666.085   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0    8674.9348665.315   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0    8676.2688666.085   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0    8676.2688667.625   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0    8662.2718666.234   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0    8661.0258665.329   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0    8661.5018663.864   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0    8663.0418663.864   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0    8663.5178665.329   0.000  0.00  0.00           C+0
CONECT    1   35                                                            
CONECT    2   36                                                            
CONECT    3    5   37                                                       
CONECT    4   24                                                            
CONECT    5    3    6                                                       
CONECT    6    5    8    9   10                                             
CONECT    7   22                                                            
CONECT    8    6   11                                                       
CONECT    9    6                                                            
CONECT   10    6                                                            
CONECT   11    8   12   13   14                                             
CONECT   12   11   29                                                       
CONECT   13   11                                                            
CONECT   14   11                                                            
CONECT   15   30                                                            
CONECT   16   18   19   27                                                  
CONECT   17   31                                                            
CONECT   18   16                                                            
CONECT   19   16                                                            
CONECT   20   32                                                            
CONECT   21   22   26                                                       
CONECT   22   21   23    7                                                  
CONECT   23   22   24                                                       
CONECT   24   23   25    4                                                  
CONECT   25   24   26   34                                                  
CONECT   26   21   25                                                       
CONECT   27   32   28   16                                                  
CONECT   28   27   29                                                       
CONECT   29   30   28   12                                                  
CONECT   30   29   31   15                                                  
CONECT   31   30   32   17                                                  
CONECT   32   27   31   20                                                  
CONECT   33   34   37                                                       
CONECT   34   35   33   25                                                  
CONECT   35   34   36    1                                                  
CONECT   36   35   37    2                                                  
CONECT   37   36   33    3                                                  
MASTER        0    0    0    0    0    0    0    0   37    0   78    0
END

COMPND    HMDB0012302
HETATM    1  O1  UNL     1      -8.672   0.093   1.516  1.00  0.00           O  
HETATM    2  C1  UNL     1      -7.429   0.131   1.730  1.00  0.00           C  
HETATM    3  O2  UNL     1      -7.017   0.106   3.048  1.00  0.00           O  
HETATM    4  C2  UNL     1      -6.457   0.201   0.584  1.00  0.00           C  
HETATM    5  O3  UNL     1      -5.196   0.230   1.130  1.00  0.00           O  
HETATM    6  C3  UNL     1      -4.174   0.125   0.208  1.00  0.00           C  
HETATM    7  O4  UNL     1      -4.112   1.162  -0.693  1.00  0.00           O  
HETATM    8  P1  UNL     1      -2.663   2.026  -0.619  1.00  0.00           P  
HETATM    9  O5  UNL     1      -2.631   2.956   0.573  1.00  0.00           O  
HETATM   10  O6  UNL     1      -2.587   2.990  -2.019  1.00  0.00           O  
HETATM   11  O7  UNL     1      -1.319   0.983  -0.618  1.00  0.00           O  
HETATM   12  P2  UNL     1      -0.180   1.627   0.422  1.00  0.00           P  
HETATM   13  O8  UNL     1      -0.313   3.148   0.355  1.00  0.00           O  
HETATM   14  O9  UNL     1      -0.424   1.176   2.021  1.00  0.00           O  
HETATM   15  O10 UNL     1       1.406   1.208  -0.008  1.00  0.00           O  
HETATM   16  C4  UNL     1       2.245   1.693   0.961  1.00  0.00           C  
HETATM   17  C5  UNL     1       3.699   1.388   0.702  1.00  0.00           C  
HETATM   18  O11 UNL     1       3.949   0.019   0.632  1.00  0.00           O  
HETATM   19  C6  UNL     1       5.306   0.025   0.265  1.00  0.00           C  
HETATM   20  N1  UNL     1       5.800  -1.294  -0.005  1.00  0.00           N  
HETATM   21  C7  UNL     1       6.795  -1.831   0.723  1.00  0.00           C  
HETATM   22  C8  UNL     1       7.303  -3.092   0.503  1.00  0.00           C  
HETATM   23  C9  UNL     1       6.773  -3.839  -0.503  1.00  0.00           C  
HETATM   24  O12 UNL     1       7.222  -5.011  -0.731  1.00  0.00           O  
HETATM   25  N2  UNL     1       5.777  -3.314  -1.239  1.00  0.00           N  
HETATM   26  C10 UNL     1       5.300  -2.074  -0.999  1.00  0.00           C  
HETATM   27  O13 UNL     1       4.369  -1.614  -1.705  1.00  0.00           O  
HETATM   28  C11 UNL     1       5.371   0.960  -0.895  1.00  0.00           C  
HETATM   29  O14 UNL     1       6.523   1.766  -0.768  1.00  0.00           O  
HETATM   30  C12 UNL     1       4.137   1.843  -0.676  1.00  0.00           C  
HETATM   31  O15 UNL     1       4.488   3.185  -0.653  1.00  0.00           O  
HETATM   32  C13 UNL     1      -4.306  -1.170  -0.557  1.00  0.00           C  
HETATM   33  O16 UNL     1      -3.301  -1.347  -1.476  1.00  0.00           O  
HETATM   34  C14 UNL     1      -5.634  -1.087  -1.318  1.00  0.00           C  
HETATM   35  O17 UNL     1      -5.789  -2.203  -2.144  1.00  0.00           O  
HETATM   36  C15 UNL     1      -6.721  -1.015  -0.269  1.00  0.00           C  
HETATM   37  O18 UNL     1      -6.683  -2.170   0.507  1.00  0.00           O  
HETATM   38  H1  UNL     1      -6.935   0.977   3.537  1.00  0.00           H  
HETATM   39  H2  UNL     1      -6.693   1.119   0.021  1.00  0.00           H  
HETATM   40  H3  UNL     1      -3.217   0.119   0.777  1.00  0.00           H  
HETATM   41  H4  UNL     1      -3.087   3.840  -1.905  1.00  0.00           H  
HETATM   42  H5  UNL     1      -0.568   0.196   2.047  1.00  0.00           H  
HETATM   43  H6  UNL     1       2.148   2.769   1.166  1.00  0.00           H  
HETATM   44  H7  UNL     1       1.982   1.173   1.918  1.00  0.00           H  
HETATM   45  H8  UNL     1       4.366   1.816   1.459  1.00  0.00           H  
HETATM   46  H9  UNL     1       5.856   0.450   1.104  1.00  0.00           H  
HETATM   47  H10 UNL     1       7.215  -1.240   1.519  1.00  0.00           H  
HETATM   48  H11 UNL     1       8.116  -3.488   1.124  1.00  0.00           H  
HETATM   49  H12 UNL     1       5.394  -3.922  -2.007  1.00  0.00           H  
HETATM   50  H13 UNL     1       5.372   0.491  -1.879  1.00  0.00           H  
HETATM   51  H14 UNL     1       6.410   2.447  -0.085  1.00  0.00           H  
HETATM   52  H15 UNL     1       3.396   1.607  -1.439  1.00  0.00           H  
HETATM   53  H16 UNL     1       4.535   3.572  -1.548  1.00  0.00           H  
HETATM   54  H17 UNL     1      -4.410  -1.985   0.177  1.00  0.00           H  
HETATM   55  H18 UNL     1      -3.533  -2.122  -2.046  1.00  0.00           H  
HETATM   56  H19 UNL     1      -5.668  -0.145  -1.908  1.00  0.00           H  
HETATM   57  H20 UNL     1      -6.402  -1.955  -2.877  1.00  0.00           H  
HETATM   58  H21 UNL     1      -7.726  -0.909  -0.707  1.00  0.00           H  
HETATM   59  H22 UNL     1      -7.404  -2.791   0.203  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   38
CONECT    4    5   36   39
CONECT    5    6
CONECT    6    7   32   40
CONECT    7    8
CONECT    8    9    9   10   11
CONECT   10   41
CONECT   11   12
CONECT   12   13   13   14   15
CONECT   14   42
CONECT   15   16
CONECT   16   17   43   44
CONECT   17   18   30   45
CONECT   18   19
CONECT   19   20   28   46
CONECT   20   21   26
CONECT   21   22   22   47
CONECT   22   23   48
CONECT   23   24   24   25
CONECT   25   26   49
CONECT   26   27   27
CONECT   28   29   30   50
CONECT   29   51
CONECT   30   31   52
CONECT   31   53
CONECT   32   33   34   54
CONECT   33   55
CONECT   34   35   36   56
CONECT   35   57
CONECT   36   37   58
CONECT   37   59
END

HMDB0012302
     RDKit          3D
UDP-D-galacturonic acid
 59 61  0  0  0  0  0  0  0  0999 V2000
   -8.6721    0.0934    1.5158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4295    0.1315    1.7298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0172    0.1058    3.0483 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4569    0.2015    0.5842 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.1962    0.2300    1.1298 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1737    0.1248    0.2080 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.1122    1.1616   -0.6928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6631    2.0258   -0.6190 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.6312    2.9563    0.5734 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5868    2.9898   -2.0194 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3189    0.9825   -0.6184 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1799    1.6273    0.4220 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.3132    3.1481    0.3549 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4242    1.1756    2.0214 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4064    1.2076   -0.0085 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2451    1.6932    0.9612 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6987    1.3884    0.7018 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9490    0.0186    0.6321 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3064    0.0254    0.2647 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7998   -1.2943   -0.0054 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7947   -1.8307    0.7225 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3032   -3.0921    0.5033 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7730   -3.8390   -0.5031 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2223   -5.0113   -0.7315 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7767   -3.3138   -1.2392 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3000   -2.0737   -0.9993 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3693   -1.6135   -1.7051 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3711    0.9596   -0.8947 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5232    1.7661   -0.7680 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1365    1.8434   -0.6765 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4876    3.1845   -0.6530 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3058   -1.1697   -0.5568 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.3010   -1.3467   -1.4763 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6337   -1.0872   -1.3181 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.7891   -2.2033   -2.1439 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7205   -1.0149   -0.2692 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.6835   -2.1699    0.5071 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9355    0.9766    3.5372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6927    1.1192    0.0209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2174    0.1195    0.7769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0870    3.8398   -1.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5681    0.1955    2.0474 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1477    2.7688    1.1661 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9820    1.1727    1.9182 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3662    1.8163    1.4595 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8558    0.4503    1.1036 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2146   -1.2397    1.5193 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1164   -3.4878    1.1239 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3941   -3.9222   -2.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3721    0.4907   -1.8787 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4100    2.4475   -0.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3956    1.6065   -1.4392 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5350    3.5718   -1.5483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4104   -1.9849    0.1771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5334   -2.1216   -2.0459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6676   -0.1451   -1.9083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4020   -1.9547   -2.8774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7260   -0.9094   -0.7075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4037   -2.7906    0.2028 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  2  0
 19 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
  6 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36  4  1  0
 30 17  1  0
 26 20  1  0
  3 38  1  0
  4 39  1  6
  6 40  1  1
 10 41  1  0
 14 42  1  0
 16 43  1  0
 16 44  1  0
 17 45  1  1
 19 46  1  1
 21 47  1  0
 22 48  1  0
 25 49  1  0
 28 50  1  6
 29 51  1  0
 30 52  1  6
 31 53  1  0
 32 54  1  1
 33 55  1  0
 34 56  1  6
 35 57  1  0
 36 58  1  6
 37 59  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
UDPgalacturonate	ChEBI
Uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphate)	ChEBI
UDPgalacturonic acid	Generator
Uridine 5'-(a-D-galactopyranosyluronate pyrophosphate)	Generator
Uridine 5'-(a-D-galactopyranosyluronic acid pyrophosphoric acid)	Generator
Uridine 5'-(alpha-D-galactopyranosyluronate pyrophosphate)	Generator
Uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphoric acid)	Generator
Uridine 5'-(α-D-galactopyranosyluronate pyrophosphate)	Generator
Uridine 5'-(α-D-galactopyranosyluronic acid pyrophosphoric acid)	Generator
UDP-D-Galacturonic acid	Generator
UDP-D-Galacturonate	ChEBI
UDP-a-D-Galacturonate	Generator
UDP-a-D-Galacturonic acid	Generator
UDP-alpha-D-Galacturonate	Generator
UDP-α-D-galacturonate	Generator
UDP-α-D-galacturonic acid	Generator
UDP-Gal-ua	MeSH
Uridine diphosphogalacturonic acid	MeSH
UDP-galacturonic acid	MeSH
UDP-GalA	HMDB
UDPGalAc	HMDB
UDPGalurAc	HMDB
Uridine diphosphate galacturonic acid	HMDB
Uridine pyrophosphate galacturonic acid	HMDB

Chemical Formula

C₁₅H₂₂N₂O₁₈P₂

Average Molecular Weight

580.2853

Monoisotopic Molecular Weight

580.034284934

IUPAC Name

(2S,3R,4S,5R,6R)-6-({[({[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

Traditional Name

udp-galacturonic acid

CAS Registry Number

50722-58-2

SMILES

O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O

InChI Identifier

InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8-,9-,10-,11+,12-,14-/m1/s1

InChI Key

HDYANYHVCAPMJV-GXNRKQDOSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pyrimidine nucleotide sugars. These are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group.

Kingdom

Organic compounds

Super Class

Nucleosides, nucleotides, and analogues

Class

Pyrimidine nucleotides

Sub Class

Pyrimidine nucleotide sugars

Direct Parent

Pyrimidine nucleotide sugars

Alternative Parents

Substituents

Pyrimidine nucleotide sugar
Pyrimidine ribonucleoside diphosphate
Pentose phosphate
Pentose-5-phosphate
Glucuronic acid or derivatives
Glycosyl compound
N-glycosyl compound
Monosaccharide phosphate
Organic pyrophosphate
Beta-hydroxy acid
Monoalkyl phosphate
Pyrimidone
Hydropyrimidine
Hydroxy acid
Monosaccharide
Organic phosphoric acid derivative
Oxane
Phosphoric acid ester
Pyran
Pyrimidine
Alkyl phosphate
Tetrahydrofuran
Vinylogous amide
Heteroaromatic compound
Secondary alcohol
Urea
Lactam
Carboxylic acid derivative
Carboxylic acid
Azacycle
Oxacycle
Organoheterocyclic compound
Monocarboxylic acid or derivatives
Polyol
Organooxygen compound
Alcohol
Organic oxygen compound
Hydrocarbon derivative
Organic nitrogen compound
Organopnictogen compound
Organic oxide
Carbonyl group
Organonitrogen compound
Aromatic heteromonocyclic compound

Molecular Framework

Aromatic heteromonocyclic compounds

External Descriptors

UDP-D-galacturonic acid (CHEBI:16085 )

Ontology

Not Available

Ingestion (HMDB: HMDB0012302)

Source

Endogenous

Endogenous (HMDB: HMDB0012302)

Plant

Animal

Animal (HMDB: HMDB0012302)

Exogenous

Food

Food (HMDB: HMDB0012302)

Animal origin

Poultry

Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)
Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Equine

Horse (FooDB: FOOD00378)

Nut

Peanut (FooDB: FOOD00016)
Cashew nut (FooDB: FOOD00011)
Brazil nut (FooDB: FOOD00024)
Pecan nut (FooDB: FOOD00044)
Chestnut (FooDB: FOOD00045)
Common hazelnut (FooDB: FOOD00062)
Black walnut (FooDB: FOOD00093)
Common walnut (FooDB: FOOD00094)
Pine nut (FooDB: FOOD00138)
Pistachio (FooDB: FOOD00140)
Almond (FooDB: FOOD00148)
Macadamia nut (M. tetraphylla) (FooDB: FOOD00225)
Japanese walnut (FooDB: FOOD00240)
Acorn (FooDB: FOOD00282)
Beech nut (FooDB: FOOD00299)
Butternut (FooDB: FOOD00316)
Chinese chestnut (FooDB: FOOD00331)
European chestnut (FooDB: FOOD00363)
Hazelnut (FooDB: FOOD00376)
Hickory nut (FooDB: FOOD00377)
Japanese chestnut (FooDB: FOOD00385)
Pili nut (FooDB: FOOD00432)
Colorado pinyon (FooDB: FOOD00433)
Macadamia nut (FooDB: FOOD00525)
Walnut (FooDB: FOOD00608)
Mixed nuts (FooDB: FOOD00771)
Nuts (FooDB: FOOD00869)

Herb and spice mixture

Curry powder (FooDB: FOOD00678)

Herbs and Spices (FooDB: FOOD00866)

Vegetable

Cabbage

Onion-family vegetable

Allium (FooDB: FOOD00005)
Garden onion (FooDB: FOOD00006)
Leek (FooDB: FOOD00007)
Garden onion (var.) (FooDB: FOOD00226)
Shallot (FooDB: FOOD00243)
Wild leek (FooDB: FOOD00396)
Red onion (FooDB: FOOD00962)
Green onion (FooDB: FOOD00963)
Onion-family vegetables (FooDB: FOOD00855)

Root vegetable

Shoot vegetable

Leaf vegetable

Common beet (FooDB: FOOD00025)
Endive (FooDB: FOOD00048)
Rocket salad (ssp.) (FooDB: FOOD00077)
Swamp cabbage (FooDB: FOOD00091)
Lettuce (FooDB: FOOD00095)
Garden cress (FooDB: FOOD00099)
Spinach (FooDB: FOOD00178)
Swiss chard (FooDB: FOOD00237)
Chicory leaves (FooDB: FOOD00250)
Garland chrysanthemum (FooDB: FOOD00333)
Corn salad (FooDB: FOOD00340)
Jute (FooDB: FOOD00389)
Lambsquarters (FooDB: FOOD00394)
Malabar spinach (FooDB: FOOD00404)
New Zealand spinach (FooDB: FOOD00415)
Yautia (FooDB: FOOD00510)
Ostrich fern (FooDB: FOOD00556)
Romaine lettuce (FooDB: FOOD00888)
Iceberg lettuce (FooDB: FOOD00973)
Pea shoots (FooDB: FOOD00975)
Yau choy (FooDB: FOOD00976)
Water spinach (FooDB: FOOD00977)
Rocket salad (FooDB: FOOD00244)
Green vegetables (FooDB: FOOD00872)

Fruit vegetable

Pepper (FooDB: FOOD00040)
Olive (FooDB: FOOD00121)
Avocado (FooDB: FOOD00130)
Garden tomato (FooDB: FOOD00171)
Cherry tomato (FooDB: FOOD00172)
Garden tomato (var.) (FooDB: FOOD00173)
Eggplant (FooDB: FOOD00174)
Pepper (C. baccatum) (FooDB: FOOD00231)
Pepper (C. chinense) (FooDB: FOOD00232)
Pepper (Capsicum) (FooDB: FOOD00233)
Groundcherry (FooDB: FOOD00371)
Pepper (C. frutescens) (FooDB: FOOD00428)
Mexican groundcherry (FooDB: FOOD00491)
Pepper (C. pubescens) (FooDB: FOOD00849)
Green bell pepper (FooDB: FOOD00877)
Yellow bell pepper (FooDB: FOOD00878)
Orange bell pepper (FooDB: FOOD00879)
Red bell pepper (FooDB: FOOD00880)
Italian sweet red pepper (FooDB: FOOD00881)
Jalapeno pepper (FooDB: FOOD00955)
Cubanelle pepper (FooDB: FOOD00971)

Tuber

Stalk vegetable

Other vegetable

Giant butterbur (FooDB: FOOD00314)
Carob (FooDB: FOOD00321)
Chinese water chestnut (FooDB: FOOD00332)
Horseradish tree (FooDB: FOOD00379)
Sacred lotus (FooDB: FOOD00402)
Nopal (FooDB: FOOD00416)
Okra (FooDB: FOOD00420)
Sesbania flower (FooDB: FOOD00469)
Agave (FooDB: FOOD00563)
Narrowleaf cattail (FooDB: FOOD00564)
Heart of palm (FooDB: FOOD00718)
Tree fern (FooDB: FOOD00797)

Mushroom

Castanospermum australe (FooDB: FOOD00893)
Gentiana lutea (FooDB: FOOD00894)
Juniperus communis (FooDB: FOOD00895)
Albizia gummifera (FooDB: FOOD00896)

Brassica

Brassicas (FooDB: FOOD00857)

Fruit

Tropical fruit

Citrus

Lime (FooDB: FOOD00053)
Lemon (FooDB: FOOD00054)
Pummelo (FooDB: FOOD00055)
Mandarin orange (Clementine, Tangerine) (FooDB: FOOD00056)
Sweet orange (FooDB: FOOD00057)
Grapefruit/Pummelo hybrid (FooDB: FOOD00255)
Grapefruit (FooDB: FOOD00256)
Persian lime (FooDB: FOOD00543)
Sour orange (FooDB: FOOD00918)
Mikan (FooDB: FOOD00932)
Clementine (FooDB: FOOD00959)
Citrus (FooDB: FOOD00859)

Pome

Berry

Black crowberry (FooDB: FOOD00075)
Strawberry (FooDB: FOOD00083)
Black huckleberry (FooDB: FOOD00084)
Sea-buckthornberry (FooDB: FOOD00087)
Mulberry (FooDB: FOOD00116)
Black mulberry (FooDB: FOOD00117)
Black chokeberry (FooDB: FOOD00136)
Blackcurrant (FooDB: FOOD00155)
Redcurrant (FooDB: FOOD00156)
Gooseberry (FooDB: FOOD00157)
Cloudberry (FooDB: FOOD00161)
Red raspberry (FooDB: FOOD00162)
Black raspberry (FooDB: FOOD00163)
Black elderberry (FooDB: FOOD00166)
Rowanberry (FooDB: FOOD00176)
Vaccinium (Blueberry, Cranberry, Huckleberry) (FooDB: FOOD00188)
Lowbush blueberry (FooDB: FOOD00189)
Sparkleberry (FooDB: FOOD00190)
Highbush blueberry (FooDB: FOOD00191)
American cranberry (FooDB: FOOD00192)
Bilberry (FooDB: FOOD00193)
Lingonberry (FooDB: FOOD00194)
Muscadine grape (FooDB: FOOD00203)
Common grape (FooDB: FOOD00204)
Arctic blackberry (FooDB: FOOD00207)
Bayberry (FooDB: FOOD00209)
Elliott's blueberry (FooDB: FOOD00210)
Canada blueberry (FooDB: FOOD00211)
Bog bilberry (FooDB: FOOD00212)
Buffalo currant (FooDB: FOOD00213)
European cranberry (FooDB: FOOD00217)
Deerberry (FooDB: FOOD00218)
Cascade huckleberry (FooDB: FOOD00220)
Oval-leaf huckleberry (FooDB: FOOD00221)
Evergreen huckleberry (FooDB: FOOD00222)
Red huckleberry (FooDB: FOOD00223)
Summer grape (FooDB: FOOD00227)
Fox grape (FooDB: FOOD00228)
Half-highbush blueberry (FooDB: FOOD00248)
Jostaberry (FooDB: FOOD00257)
Sweet rowanberry (FooDB: FOOD00265)
Skunk currant (FooDB: FOOD00267)
Squashberry (FooDB: FOOD00344)
Elderberry (FooDB: FOOD00358)
Grape (FooDB: FOOD00369)
Alaska blueberry (FooDB: FOOD00380)
Loganberry (FooDB: FOOD00400)
Ohelo berry (FooDB: FOOD00419)
Salmonberry (FooDB: FOOD00456)
Strawberry guava (FooDB: FOOD00482)
Boysenberry (FooDB: FOOD00542)
Chinese bayberry (FooDB: FOOD00852)
Saskatoon berry (FooDB: FOOD00884)
Nanking cherry (FooDB: FOOD00885)
Rabbiteye blueberry (FooDB: FOOD00898)
Blackberry (FooDB: FOOD00906)
Partridge berry (FooDB: FOOD00931)
Green grape (FooDB: FOOD00964)
Red grape (FooDB: FOOD00965)
Black plum (FooDB: FOOD00966)
Black raisin (FooDB: FOOD00968)
Chinese plum (FooDB: FOOD00978)
Green plum (FooDB: FOOD00979)
Wampee (FooDB: FOOD00980)
Goji (FooDB: FOOD00982)
Monk fruit (FooDB: FOOD00983)
Hawthorn (FooDB: FOOD00985)
Lantern fruit (FooDB: FOOD00986)
Cape gooseberry (FooDB: FOOD00988)
Rubus (Blackberry, Raspberry) (FooDB: FOOD00160)

Other fruit

Fig (FooDB: FOOD00081)
Date (FooDB: FOOD00135)
Jujube (FooDB: FOOD00388)

Drupe

Prunus (Cherry, Plum) (FooDB: FOOD00143)
Apricot (FooDB: FOOD00144)
Sweet cherry (FooDB: FOOD00145)
Sour cherry (FooDB: FOOD00146)
European plum (FooDB: FOOD00147)
Peach (FooDB: FOOD00149)
Nectarine (FooDB: FOOD00229)
Peach (var.) (FooDB: FOOD00230)
Common chokecherry (FooDB: FOOD00562)

Fruits (FooDB: FOOD00871)

Cereal and cereal product

Cereal

Cereal product

Dough

Sourdough (FooDB: FOOD00275)

Leavened bread

Flat bread

Other bread

Potato bread (FooDB: FOOD00811)
Other bread (FooDB: FOOD00269)

Sweet bread

Raisin bread (FooDB: FOOD00817)

Cereals and cereal products (FooDB: FOOD00858)

Pulse

Pea

Lentil

Lentils (FooDB: FOOD00098)

Other pulse

Lupine (FooDB: FOOD00104)
White lupine (FooDB: FOOD00403)

Bean

Green lentil (FooDB: FOOD00970)
Pulses (FooDB: FOOD00867)

Gourd

Watermelon (FooDB: FOOD00052)
Muskmelon (FooDB: FOOD00064)
Cucumber (FooDB: FOOD00065)
Cucurbita (FooDB: FOOD00066)
Bitter gourd (FooDB: FOOD00115)
Winter squash (FooDB: FOOD00283)
Butternut squash (FooDB: FOOD00317)
Calabash (FooDB: FOOD00318)
Chayote (FooDB: FOOD00325)
Towel gourd (FooDB: FOOD00492)
Wax gourd (FooDB: FOOD00499)
Tinda (FooDB: FOOD00559)
Horned melon (FooDB: FOOD00761)
Sunburst squash (pattypan squash) (FooDB: FOOD00874)
Green zucchini (FooDB: FOOD00875)
Yellow zucchini (FooDB: FOOD00876)
Japanese pumpkin (FooDB: FOOD00886)
Acorn squash (FooDB: FOOD00972)
Cantaloupe melon (FooDB: FOOD00984)

Coffee and coffee product

Coffee

Arabica coffee (FooDB: FOOD00059)
Robusta coffee (FooDB: FOOD00060)

Soy

Soy bean (FooDB: FOOD00085)

Soy product

Dish

Other dish

Taco shell (FooDB: FOOD00991)
Tostada shell (FooDB: FOOD00992)

Tea

Herbal tea

Hibiscus tea (FooDB: FOOD00723)
Greenthread tea (FooDB: FOOD00820)

Baking good

Wrapper

Wonton wrapper (FooDB: FOOD00818)

Abalone (FooDB: FOOD00279)
Conch (FooDB: FOOD00611)

Cocoa and cocoa product

Cocoa

Cocoa bean (FooDB: FOOD00182)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

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	18.1 g/L	ALOGPS
logP	-1.2	ALOGPS
logP	-4.7	ChemAxon
logS	-1.5	ALOGPS
pKa (Strongest Acidic)	1.72	ChemAxon
pKa (Strongest Basic)	-3.7	ChemAxon
Physiological Charge	-3	ChemAxon
Hydrogen Acceptor Count	15	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	308.61 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	106.32 m³·mol⁻¹	ChemAxon
Polarizability	46.96 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	216.776	30932474
DeepCCS	[M-H]-	214.947	30932474
DeepCCS	[M-2H]-	248.982	30932474
DeepCCS	[M+Na]+	223.0	30932474
AllCCS	[M+H]+	214.2	32859911
AllCCS	[M+H-H2O]+	212.8	32859911
AllCCS	[M+NH4]+	215.5	32859911
AllCCS	[M+Na]+	215.8	32859911
AllCCS	[M-H]-	208.5	32859911
AllCCS	[M+Na-2H]-	209.4	32859911
AllCCS	[M+HCOO]-	210.7	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.	3.44 minutes	32390414
Predicted by Siyang on May 30, 2022	11.4003 minutes	33406817
Predicted by Siyang using ReTip algorithm on June 8, 2022	9.74 minutes	32390414
AjsUoB = Accucore 150 Amide HILIC with 10mM Ammonium Formate, 0.1% Formic Acid	503.8 seconds	40023050
Fem_Long = Waters ACQUITY UPLC HSS T3 C18 with Water:MeOH and 0.1% Formic Acid	498.5 seconds	40023050
Fem_Lipids = Ascentis Express C18 with (60:40 water:ACN):(90:10 IPA:ACN) and 10mM NH4COOH + 0.1% Formic Acid	254.9 seconds	40023050
Life_Old = Waters ACQUITY UPLC BEH C18 with Water:(20:80 acetone:ACN) and 0.1% Formic Acid	25.8 seconds	40023050
Life_New = RP Waters ACQUITY UPLC HSS T3 C18 with Water:(30:70 MeOH:ACN) and 0.1% Formic Acid	183.9 seconds	40023050
RIKEN = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	76.7 seconds	40023050
Eawag_XBridgeC18 = XBridge C18 3.5u 2.1x50 mm with Water:MeOH and 0.1% Formic Acid	329.5 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	302.6 seconds	40023050
HILIC_BDD_2 = Merck SeQuant ZIC-HILIC with ACN(0.1% formic acid):water(16 mM ammonium formate)	910.0 seconds	40023050
UniToyama_Atlantis = RP Waters Atlantis T3 (2.1 x 150 mm, 5 um) with ACN:Water and 0.1% Formic Acid	605.0 seconds	40023050
BDD_C18 = Hypersil Gold 1.9µm C18 with Water:ACN and 0.1% Formic Acid	116.6 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	802.8 seconds	40023050
SNU_RIKEN_POS = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	217.0 seconds	40023050
RPMMFDA = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	373.9 seconds	40023050
MTBLS87 = Merck SeQuant ZIC-pHILIC column with ACN:Water and :ammonium carbonate	929.1 seconds	40023050
KI_GIAR_zic_HILIC_pH2_7 = Merck SeQuant ZIC-HILIC with ACN:Water and 0.1% FA	410.6 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	666.7 seconds	40023050

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
UDP-D-galacturonic acid	O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O	4906.5	Standard polar	33892256
UDP-D-galacturonic acid	O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O	3268.8	Standard non polar	33892256
UDP-D-galacturonic acid	O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O	4827.7	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
UDP-D-galacturonic acid,1TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4335.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #2	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O	4308.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #3	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@@H]1O	4274.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O	4311.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4298.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1N1C=CC(=O)[NH]C1=O	4325.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #7	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O)OP(=O)(O)O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O	4385.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #8	C[Si](C)(C)OP(=O)(O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O	4399.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TMS,isomer #9	C[Si](C)(C)N1C(=O)C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)C1=O	4421.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4149.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #10	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O	4135.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #11	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O	4136.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #12	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C	4130.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #13	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O	4218.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #14	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O	4205.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #15	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O	4313.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #16	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4093.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #17	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@@H]1O	4093.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #18	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@@H]1O[Si](C)(C)C	4138.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #19	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@@H]1O	4184.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4146.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #20	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O	4171.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #21	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@@H]1O	4285.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #22	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4137.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O	4142.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #24	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O	4224.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	4210.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O)[C@@H]1O	4320.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #27	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4142.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #28	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4226.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #29	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4213.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #3	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@@H]1O	4105.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #30	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4306.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #31	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1N1C=CC(=O)[NH]C1=O	4212.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #32	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@H]1N1C=CC(=O)[NH]C1=O	4223.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #33	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1N1C=CC(=O)N([Si](C)(C)C)C1=O	4327.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #34	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O)OP(=O)(O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)O[Si](C)(C)C	4278.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #35	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O)[C@@H]1O)OP(=O)(O)O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O	4367.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #36	C[Si](C)(C)OP(=O)(O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O)[C@@H]1O	4379.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4153.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O[Si](C)(C)C	4176.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4225.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4234.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4329.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4147.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4037.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #10	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O	4020.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4047.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4053.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4160.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #14	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@@H]1O	3993.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4005.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #16	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@@H]1O	4032.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #17	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	4024.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #18	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@@H]1O	4133.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4030.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4008.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #20	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4054.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4063.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4169.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O[Si](C)(C)C	4074.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #24	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O[Si](C)(C)C	4080.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O[Si](C)(C)C	4185.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4100.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #27	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4225.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4225.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #29	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4013.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	3979.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #30	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	4011.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #31	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4006.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #32	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4073.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #33	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4067.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #34	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4166.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #35	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O	3997.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #36	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C	3993.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #37	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O	4048.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #38	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O	4042.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #39	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O	4151.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #4	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4013.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #40	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4034.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #41	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O	4053.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #42	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4041.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #43	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O	4152.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #44	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C	4048.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #45	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4037.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #46	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C	4151.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #47	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O	4090.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #48	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O	4213.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #49	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O	4211.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4069.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #50	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	3976.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #51	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	4007.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #52	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4033.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #53	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4026.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #54	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4130.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #55	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@@H]1O[Si](C)(C)C	4002.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #56	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@@H]1O	4026.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #57	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O	4016.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #58	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@@H]1O	4123.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #59	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@@H]1O[Si](C)(C)C	4057.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4064.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #60	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4044.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #61	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@@H]1O[Si](C)(C)C	4159.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #62	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O	4066.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #63	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@@H]1O	4188.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #64	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O	4185.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #65	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4008.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #66	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4067.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #67	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4058.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #68	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4162.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #69	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O	4059.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #7	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4170.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #70	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	4050.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #71	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O	4161.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #72	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	4094.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #73	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O)[C@@H]1O	4224.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #74	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	4219.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #75	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4071.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #76	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4066.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #77	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4164.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #78	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4108.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #79	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4222.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3996.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #80	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4220.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #81	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@H]1N1C=CC(=O)[NH]C1=O	4095.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #82	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1N1C=CC(=O)N([Si](C)(C)C)C1=O	4215.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #83	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@H]1N1C=CC(=O)N([Si](C)(C)C)C1=O	4217.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #84	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O)[C@@H]1O)OP(=O)(O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)O[Si](C)(C)C	4259.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,3TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3999.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	3953.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #10	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	3983.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #100	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4086.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #101	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4082.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #102	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@@H]1O[Si](C)(C)C	3987.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #103	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3975.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #104	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@@H]1O[Si](C)(C)C	4058.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #105	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O	3998.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #106	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@@H]1O	4070.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #107	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O	4067.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #108	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4018.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #109	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@@H]1O[Si](C)(C)C	4095.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #11	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4061.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #110	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4091.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #111	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@@H]1O	4106.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #112	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	3991.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #113	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	3980.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #114	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4062.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #115	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4026.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #116	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4107.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #117	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	4102.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #118	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	4015.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #119	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O	4093.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #12	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3938.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #120	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O)O[Si](C)(C)C	4092.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #121	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	4127.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #122	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4029.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #123	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4105.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #124	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4103.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #125	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4133.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #126	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@H]1N1C=CC(=O)N([Si](C)(C)C)C1=O	4121.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #13	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	3982.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #14	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	3968.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #15	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4041.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #16	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	3997.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #17	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	3987.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #18	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4067.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #19	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4033.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	3932.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #20	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4106.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #21	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4107.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #22	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3964.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #23	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	3950.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #24	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3975.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3988.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4056.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #27	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	3950.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3980.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #29	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3991.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	3954.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #30	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4054.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #31	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O	3992.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #32	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H]1O	3983.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #33	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O	4078.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #34	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4018.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #35	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4089.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #36	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4087.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #37	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3953.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #38	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@@H]1O	3981.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #39	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	3968.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #4	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4008.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #40	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@@H]1O	4057.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #41	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3981.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #42	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	3993.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #43	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4061.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #44	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	4010.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #45	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@@H]1O	4075.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #46	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	4073.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #47	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3997.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #48	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)O[Si](C)(C)C	3989.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #49	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4082.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	3998.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #50	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4024.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #51	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4096.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #52	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4096.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #53	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O[Si](C)(C)C	4025.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #54	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O[Si](C)(C)C	4111.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #55	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O[Si](C)(C)C	4108.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #56	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C)O[C@@H](N2C=CC(=O)N([Si](C)(C)C)C2=O)[C@@H]1O	4126.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #57	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3938.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #58	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3934.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #59	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	3995.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4086.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #60	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	3984.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #61	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4067.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #62	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3977.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #63	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3998.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #64	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3989.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #65	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	4065.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #66	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3995.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #67	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3983.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #68	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4064.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #69	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4033.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #7	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3939.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #70	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4110.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #71	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	4110.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #72	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3963.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #73	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O	3986.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #74	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	3975.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #75	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O	4053.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #76	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C	3982.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #77	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	3969.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #78	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C	4053.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #79	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O	4010.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	3939.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #80	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O	4083.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #81	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O	4086.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #82	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4005.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #83	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3992.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #84	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4096.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #85	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4017.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #86	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O	4091.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #87	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4088.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #88	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4013.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #89	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C	4090.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	3994.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #90	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4084.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #91	C[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@H]1O	4121.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #92	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3935.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #93	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	3978.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #94	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	3962.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #95	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4040.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #96	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3998.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #97	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	3986.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #98	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	4063.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,4TMS,isomer #99	C[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	4014.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4529.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O	4492.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@@H]1O	4468.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O	4502.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4525.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1N1C=CC(=O)[NH]C1=O	4519.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O)OP(=O)(O)O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O	4583.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O	4600.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N1C(=O)C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)C1=O	4626.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4554.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H]1O	4515.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4498.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4494.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O	4561.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	4550.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C(C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@H]1O	4631.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4501.7	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@@H]1O	4485.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@@H]1O[Si](C)(C)C(C)(C)C	4501.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@@H]1O	4536.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4520.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C(C)(C)C)[C@@H]1O	4522.6	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C(C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@@H]1O	4613.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	4532.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4520.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O	4570.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	4555.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C(C)(C)C)C2=O)[C@H](O)[C@@H]1O	4642.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4552.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4602.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	4592.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](C(=O)O)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@@H]1O	4490.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)N([Si](C)(C)C(C)(C)C)C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O	4671.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #31	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)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1N1C=CC(=O)[NH]C1=O	4575.2	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C(C)(C)C)O[C@H]1N1C=CC(=O)[NH]C1=O	4584.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1N1C=CC(=O)N([Si](C)(C)C(C)(C)C)C1=O	4663.5	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)[NH]C2=O)[C@H](O)[C@@H]1O)OP(=O)(O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)O[Si](C)(C)C(C)(C)C	4626.0	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C(C)(C)C)C2=O)[C@H](O)[C@@H]1O)OP(=O)(O)O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O	4712.9	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(=O)N([Si](C)(C)C(C)(C)C)C2=O)[C@H](O)[C@@H]1O	4720.8	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4525.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O[Si](C)(C)C(C)(C)C	4550.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #6	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)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4581.1	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[Si](C)(C)C(C)(C)C)O[C@@H](N2C=CC(=O)[NH]C2=O)[C@@H]1O	4590.3	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)O[C@@H](N2C=CC(=O)N([Si](C)(C)C(C)(C)C)C2=O)[C@@H]1O	4667.4	Semi standard non polar	33892256
UDP-D-galacturonic acid,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](N3C=CC(=O)[NH]C3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4541.8	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (Non-derivatized) - 70eV, Positive	splash10-0w29-3322930000-0ce18416678ea80bec67	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (1 TMS) - 70eV, Positive	splash10-004r-4862914000-b91973e084ab99d92364	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS ("UDP-D-galacturonic acid,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - UDP-D-galacturonic acid GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-15	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 - UDP-D-galacturonic acid 10V, Positive-QTOF	splash10-03di-0901110000-1e6ffaa5a5ce0874c952	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 20V, Positive-QTOF	splash10-03di-4911000000-15ed26bead1c905551e0	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 40V, Positive-QTOF	splash10-03di-4900000000-2f5aaa01239a87e8ea45	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 10V, Negative-QTOF	splash10-03g3-4502290000-4f7ce7e1f9b4eebe1216	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 20V, Negative-QTOF	splash10-03ec-9605020000-2d710d0bd9ce2bdec018	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 40V, Negative-QTOF	splash10-08i3-4901000000-e4482078a9a42b9b8cab	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 10V, Negative-QTOF	splash10-004i-0001090000-c773521e9e340d5e6564	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 20V, Negative-QTOF	splash10-055e-9424840000-deea5ee6888efff36f31	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 40V, Negative-QTOF	splash10-0a5a-3936510000-b41af0ea55c95b9da1e1	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 10V, Positive-QTOF	splash10-03di-1700490000-7f9159b24d34e9358740	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 20V, Positive-QTOF	splash10-03di-4921760000-cd1fe2a62f343b8eb5ba	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - UDP-D-galacturonic acid 40V, Positive-QTOF	splash10-0209-6940100000-aa916ad8a0ed15e6eb2a	2021-09-24	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	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

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

15592253

PDB ID

UGB

ChEBI ID

16085

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Not Available

Enzymes

Enzyme Details

1. UDP-glucuronosyltransferase 2B4

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGTs are of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isozyme is active on polyhydroxylated estrogens (such as estriol, 4-hydroxyestrone and 2-hydroxyestriol) and xenobiotics (such as 4-methylumbelliferone, 1-naphthol, 4-nitrophenol, 2-aminophenol, 4-hydroxybiphenyl and menthol). It is capable of 6 alpha-hydroxyglucuronidation of hyodeoxycholic acid.
Gene Name:: UGT2B4
Uniprot ID:: P06133
Molecular weight:: 60512.035

Enzyme Details

2. UDP-glucuronosyltransferase 1-4

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform glucuronidates bilirubin IX-alpha to form both the IX-alpha-C8 and IX-alpha-C12 monoconjugates and diconjugate.
Gene Name:: UGT1A4
Uniprot ID:: P22310
Molecular weight:: 60024.535

Enzyme Details

3. UDP-glucuronosyltransferase 2B7

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. Its unique specificity for 3,4-catechol estrogens and estriol suggests it may play an important role in regulating the level and activity of these potent and active estrogen metabolites. Is also active with androsterone, hyodeoxycholic acid and tetrachlorocatechol (in vitro).
Gene Name:: UGT2B7
Uniprot ID:: P16662
Molecular weight:: 60720.15

Enzyme Details

4. UDP-glucuronosyltransferase 1-1

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform glucuronidates bilirubin IX-alpha to form both the IX-alpha-C8 and IX-alpha-C12 monoconjugates and diconjugate. Is also able to catalyze the glucuronidation of 17beta-estradiol, 17alpha-ethinylestradiol, 1-hydroxypyrene, 4-methylumbelliferone, 1-naphthol, paranitrophenol, scopoletin, and umbelliferone.
Gene Name:: UGT1A1
Uniprot ID:: P22309
Molecular weight:: 59590.91

Enzyme Details

5. UDP-glucuronosyltransferase 1-9

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform has specificity for phenols.
Gene Name:: UGT1A9
Uniprot ID:: O60656
Molecular weight:: 59940.495

Enzyme Details

6. UDP-glucuronosyltransferase 1-6

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform has specificity for phenols.
Gene Name:: UGT1A6
Uniprot ID:: P19224
Molecular weight:: 60750.215

Showing metabocard for UDP-D-galacturonic acid (HMDB0012302)

MOL for HMDB0012302 (UDP-D-galacturonic acid)

3D MOL for HMDB0012302 (UDP-D-galacturonic acid)

3D SDF for HMDB0012302 (UDP-D-galacturonic acid)

3D-SDF for HMDB0012302 (UDP-D-galacturonic acid)

PDB for HMDB0012302 (UDP-D-galacturonic acid)

3D PDB for HMDB0012302 (UDP-D-galacturonic acid)

SMILES for HMDB0012302 (UDP-D-galacturonic acid)

INCHI for HMDB0012302 (UDP-D-galacturonic acid)

Structure for HMDB0012302 (UDP-D-galacturonic acid)

3D Structure for HMDB0012302 (UDP-D-galacturonic acid)

Predicted Collision Cross Sections

Predicted Retention Times

Underivatized

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes