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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-12 03:33:28 UTC

Update Date

2022-03-07 02:57:06 UTC

HMDB ID

HMDB0041639

Secondary Accession Numbers

HMDB41639

Metabolite Identification

Common Name

(-)-Epigallocatechin 3-glucuronide

Description

(-)-Epigallocatechin 3-glucuronide belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Based on a literature review a small amount of articles have been published on (-)-Epigallocatechin 3-glucuronide.

Structure

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

  Mrv0541 02271201272D          

 34 37  0  0  1  0            999 V2000
   -0.8826   -1.2375    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.5971   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3115   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3115   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5971    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8826   -0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1681    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5464   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2608    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9753   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2608    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9753    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5464    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1681    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0260    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7405   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4549    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7405   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0260   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0260   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1681   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5464    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2608   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5463   -3.7125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5464   -2.8875    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2608   -2.4751    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1681   -2.4749    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8826   -2.8874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8827   -3.7125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1682   -4.1250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1682   -4.9499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5971   -4.1249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5972   -4.9499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3116   -3.7123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  6  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
  7 14  1  0  0  0  0
  4 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
  3 19  1  0  0  0  0
 19 20  1  0  0  0  0
  1 21  1  6  0  0  0
 13 22  1  0  0  0  0
 27 21  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 26  1  6  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 24 30  1  0  0  0  0
 30 31  1  6  0  0  0
 29 32  1  1  0  0  0
 32 33  1  0  0  0  0
 32 34  2  0  0  0  0
M  END

HMDB0041639
     RDKit          3D
(-)-Epigallocatechin 3-glucuronide
 56 59  0  0  0  0  0  0  0  0999 V2000
    3.8377    0.3303    2.5940 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7959    0.0479    1.9416 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9281    1.0825    1.6631 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6085   -1.3652    1.5411 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4566   -1.4900    0.8213 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3629   -0.8456   -0.3708 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5146    0.2251   -0.3449 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5940    0.1169   -1.1424 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.6304    1.1157   -2.2603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3293    2.3712   -1.9810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3465    3.3591   -2.9187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7056    3.1732   -4.1289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0033    4.5611   -2.6775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6592    4.8014   -1.4891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2960    6.0167   -1.3044 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6242    3.7840   -0.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9689    2.5754   -0.7924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9447    1.5671    0.1506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8413    0.2213   -0.3286 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9870   -0.7476    0.7563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7266   -1.9086    0.6411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8669   -2.8054    1.6641 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6189   -3.9469    1.4869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2662   -2.5917    2.8840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4074   -3.5039    3.9288 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5198   -1.4461    3.0405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8798   -1.1516    4.2366 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3910   -0.5424    1.9772 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7065   -0.5577   -1.0068 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5349   -0.5143   -2.3915 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5669   -1.7743   -0.7064 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.7973   -1.7010   -1.3496 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8106   -1.8246    0.7722 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1646   -3.1069    1.2020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3300    1.4561    2.3848 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5194   -1.9499    2.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8828   -1.5894   -1.0865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5718   -0.8955   -1.6490 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4087    1.3987   -2.5997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1070    0.6836   -3.1897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2300    2.3051   -4.3078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9976    5.3181   -3.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2742    6.1214   -1.5803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1249    3.9289    0.3842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6887    0.0301   -1.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1980   -2.0594   -0.3427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0747   -4.1337    0.5982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9631   -3.3305    4.8069 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8740   -1.6798    5.0681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7978    0.3457    2.1361 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2048    0.3346   -0.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4324   -0.6237   -2.8157 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0339   -2.7145   -0.9908 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8277   -2.2032   -2.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6476   -1.1120    0.9921 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1365   -3.1557    1.4645 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  1  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 22 24  2  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  2  0
  6 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33  4  1  0
 19  8  1  0
 28 20  1  0
 17 10  1  0
  3 35  1  0
  4 36  1  1
  6 37  1  6
  8 38  1  6
  9 39  1  0
  9 40  1  0
 12 41  1  0
 13 42  1  0
 15 43  1  0
 16 44  1  0
 19 45  1  6
 21 46  1  0
 23 47  1  0
 25 48  1  0
 27 49  1  0
 28 50  1  0
 29 51  1  1
 30 52  1  0
 31 53  1  6
 32 54  1  0
 33 55  1  6
 34 56  1  0
M  END

  Mrv0541 02271201272D          

 34 37  0  0  1  0            999 V2000
   -0.8826   -1.2375    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.5971   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3115   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3115   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5971    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8826   -0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1681    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5464   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2608    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9753   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2608    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9753    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5464    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1681    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0260    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7405   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4549    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7405   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0260   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0260   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1681   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5464    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2608   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5463   -3.7125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5464   -2.8875    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2608   -2.4751    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1681   -2.4749    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8826   -2.8874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8827   -3.7125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1682   -4.1250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1682   -4.9499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5971   -4.1249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5972   -4.9499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3116   -3.7123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  6  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
  7 14  1  0  0  0  0
  4 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
  3 19  1  0  0  0  0
 19 20  1  0  0  0  0
  1 21  1  6  0  0  0
 13 22  1  0  0  0  0
 27 21  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 26  1  6  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 24 30  1  0  0  0  0
 30 31  1  6  0  0  0
 29 32  1  1  0  0  0
 32 33  1  0  0  0  0
 32 34  2  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0041639

> <DATABASE_NAME>
hmdb

> <SMILES>
O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CC3=C(O[C@@H]2C2=CC(O)=C(O)C(O)=C2)C=C(O)C=C3O)O[C@@H]([C@H]1O)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C21H22O13/c22-7-3-9(23)8-5-13(33-21-17(29)15(27)16(28)19(34-21)20(30)31)18(32-12(8)4-7)6-1-10(24)14(26)11(25)2-6/h1-4,13,15-19,21-29H,5H2,(H,30,31)/t13-,15+,16+,17-,18-,19+,21-/m1/s1

> <INCHI_KEY>
ZTOAOZDTXSRHIB-BBGDWMAASA-N

> <FORMULA>
C21H22O13

> <MOLECULAR_WEIGHT>
482.3916

> <EXACT_MASS>
482.10604079

> <JCHEM_ACCEPTOR_COUNT>
13

> <JCHEM_AVERAGE_POLARIZABILITY>
43.991977973150036

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S,3S,4S,5R,6R)-6-{[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

> <ALOGPS_LOGP>
1.05

> <JCHEM_LOGP>
0.040980586000000346

> <ALOGPS_LOGS>
-2.12

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
8.728081335973082

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.893723021578656

> <JCHEM_PKA_STRONGEST_BASIC>
-3.9483983261058038

> <JCHEM_POLAR_SURFACE_AREA>
226.82999999999996

> <JCHEM_REFRACTIVITY>
108.26129999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.70e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2S,3S,4S,5R,6R)-6-{[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0041639
     RDKit          3D
(-)-Epigallocatechin 3-glucuronide
 56 59  0  0  0  0  0  0  0  0999 V2000
    3.8377    0.3303    2.5940 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7959    0.0479    1.9416 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9281    1.0825    1.6631 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6085   -1.3652    1.5411 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4566   -1.4900    0.8213 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3629   -0.8456   -0.3708 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5146    0.2251   -0.3449 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5940    0.1169   -1.1424 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.6304    1.1157   -2.2603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3293    2.3712   -1.9810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3465    3.3591   -2.9187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7056    3.1732   -4.1289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0033    4.5611   -2.6775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6592    4.8014   -1.4891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2960    6.0167   -1.3044 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6242    3.7840   -0.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9689    2.5754   -0.7924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9447    1.5671    0.1506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8413    0.2213   -0.3286 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9870   -0.7476    0.7563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7266   -1.9086    0.6411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8669   -2.8054    1.6641 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6189   -3.9469    1.4869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2662   -2.5917    2.8840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4074   -3.5039    3.9288 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5198   -1.4461    3.0405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8798   -1.1516    4.2366 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3910   -0.5424    1.9772 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7065   -0.5577   -1.0068 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5349   -0.5143   -2.3915 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5669   -1.7743   -0.7064 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.7973   -1.7010   -1.3496 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8106   -1.8246    0.7722 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1646   -3.1069    1.2020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3300    1.4561    2.3848 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5194   -1.9499    2.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8828   -1.5894   -1.0865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5718   -0.8955   -1.6490 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4087    1.3987   -2.5997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1070    0.6836   -3.1897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2300    2.3051   -4.3078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9976    5.3181   -3.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2742    6.1214   -1.5803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1249    3.9289    0.3842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6887    0.0301   -1.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1980   -2.0594   -0.3427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0747   -4.1337    0.5982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9631   -3.3305    4.8069 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8740   -1.6798    5.0681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7978    0.3457    2.1361 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2048    0.3346   -0.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4324   -0.6237   -2.8157 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0339   -2.7145   -0.9908 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8277   -2.2032   -2.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6476   -1.1120    0.9921 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1365   -3.1557    1.4645 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  1  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 22 24  2  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  2  0
  6 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33  4  1  0
 19  8  1  0
 28 20  1  0
 17 10  1  0
  3 35  1  0
  4 36  1  1
  6 37  1  6
  8 38  1  6
  9 39  1  0
  9 40  1  0
 12 41  1  0
 13 42  1  0
 15 43  1  0
 16 44  1  0
 19 45  1  6
 21 46  1  0
 23 47  1  0
 25 48  1  0
 27 49  1  0
 28 50  1  0
 29 51  1  1
 30 52  1  0
 31 53  1  6
 32 54  1  0
 33 55  1  6
 34 56  1  0
M  END

HEADER    PROTEIN                                 27-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-FEB-12         0                                  
HETATM    1  C   UNK     0      -1.648  -2.310   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -2.981  -3.080   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -4.315  -2.310   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -4.315  -0.770   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0      -2.981   0.000   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -1.648  -0.770   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -0.314   0.000   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.020  -0.770   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       2.353   0.000   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       3.687  -0.770   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       2.353   1.540   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       3.687   2.310   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       1.020   2.310   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -0.314   1.540   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -5.649   0.000   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -6.982  -0.770   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      -8.316   0.000   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      -6.982  -2.310   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -5.649  -3.080   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      -5.649  -4.620   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      -0.314  -3.080   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0       1.020   3.850   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       2.353  -7.700   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       1.020  -6.930   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       1.020  -5.390   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0       2.353  -4.620   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      -0.314  -4.620   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      -1.648  -5.390   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0      -1.648  -6.930   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      -0.314  -7.700   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      -0.314  -9.240   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      -2.981  -7.700   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      -2.981  -9.240   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0      -4.315  -6.930   0.000  0.00  0.00           O+0
CONECT    1    2    6   21                                                  
CONECT    2    1    3                                                       
CONECT    3    2    4   19                                                  
CONECT    4    3    5   15                                                  
CONECT    5    4    6                                                       
CONECT    6    5    1    7                                                  
CONECT    7    6    8   14                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11   14   22                                                  
CONECT   14   13    7                                                       
CONECT   15    4   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19                                                       
CONECT   19   18    3   20                                                  
CONECT   20   19                                                            
CONECT   21    1   27                                                       
CONECT   22   13                                                            
CONECT   23   24                                                            
CONECT   24   23   25   30                                                  
CONECT   25   24   26   27                                                  
CONECT   26   25                                                            
CONECT   27   21   25   28                                                  
CONECT   28   27   29                                                       
CONECT   29   28   30   32                                                  
CONECT   30   29   24   31                                                  
CONECT   31   30                                                            
CONECT   32   29   33   34                                                  
CONECT   33   32                                                            
CONECT   34   32                                                            
MASTER        0    0    0    0    0    0    0    0   34    0   74    0
END

COMPND    HMDB0041639
HETATM    1  O1  UNL     1       3.838   0.330   2.594  1.00  0.00           O  
HETATM    2  C1  UNL     1       2.796   0.048   1.942  1.00  0.00           C  
HETATM    3  O2  UNL     1       1.928   1.082   1.663  1.00  0.00           O  
HETATM    4  C2  UNL     1       2.609  -1.365   1.541  1.00  0.00           C  
HETATM    5  O3  UNL     1       1.457  -1.490   0.821  1.00  0.00           O  
HETATM    6  C3  UNL     1       1.363  -0.846  -0.371  1.00  0.00           C  
HETATM    7  O4  UNL     1       0.515   0.225  -0.345  1.00  0.00           O  
HETATM    8  C4  UNL     1      -0.594   0.117  -1.142  1.00  0.00           C  
HETATM    9  C5  UNL     1      -0.630   1.116  -2.260  1.00  0.00           C  
HETATM   10  C6  UNL     1      -1.329   2.371  -1.981  1.00  0.00           C  
HETATM   11  C7  UNL     1      -1.346   3.359  -2.919  1.00  0.00           C  
HETATM   12  O5  UNL     1      -0.706   3.173  -4.129  1.00  0.00           O  
HETATM   13  C8  UNL     1      -2.003   4.561  -2.677  1.00  0.00           C  
HETATM   14  C9  UNL     1      -2.659   4.801  -1.489  1.00  0.00           C  
HETATM   15  O6  UNL     1      -3.296   6.017  -1.304  1.00  0.00           O  
HETATM   16  C10 UNL     1      -2.624   3.784  -0.561  1.00  0.00           C  
HETATM   17  C11 UNL     1      -1.969   2.575  -0.792  1.00  0.00           C  
HETATM   18  O7  UNL     1      -1.945   1.567   0.151  1.00  0.00           O  
HETATM   19  C12 UNL     1      -1.841   0.221  -0.329  1.00  0.00           C  
HETATM   20  C13 UNL     1      -1.987  -0.748   0.756  1.00  0.00           C  
HETATM   21  C14 UNL     1      -2.727  -1.909   0.641  1.00  0.00           C  
HETATM   22  C15 UNL     1      -2.867  -2.805   1.664  1.00  0.00           C  
HETATM   23  O8  UNL     1      -3.619  -3.947   1.487  1.00  0.00           O  
HETATM   24  C16 UNL     1      -2.266  -2.592   2.884  1.00  0.00           C  
HETATM   25  O9  UNL     1      -2.407  -3.504   3.929  1.00  0.00           O  
HETATM   26  C17 UNL     1      -1.520  -1.446   3.041  1.00  0.00           C  
HETATM   27  O10 UNL     1      -0.880  -1.152   4.237  1.00  0.00           O  
HETATM   28  C18 UNL     1      -1.391  -0.542   1.977  1.00  0.00           C  
HETATM   29  C19 UNL     1       2.707  -0.558  -1.007  1.00  0.00           C  
HETATM   30  O11 UNL     1       2.535  -0.514  -2.392  1.00  0.00           O  
HETATM   31  C20 UNL     1       3.567  -1.774  -0.706  1.00  0.00           C  
HETATM   32  O12 UNL     1       4.797  -1.701  -1.350  1.00  0.00           O  
HETATM   33  C21 UNL     1       3.811  -1.825   0.772  1.00  0.00           C  
HETATM   34  O13 UNL     1       4.165  -3.107   1.202  1.00  0.00           O  
HETATM   35  H1  UNL     1       1.330   1.456   2.385  1.00  0.00           H  
HETATM   36  H2  UNL     1       2.519  -1.950   2.508  1.00  0.00           H  
HETATM   37  H3  UNL     1       0.883  -1.589  -1.086  1.00  0.00           H  
HETATM   38  H4  UNL     1      -0.572  -0.896  -1.649  1.00  0.00           H  
HETATM   39  H5  UNL     1       0.409   1.399  -2.600  1.00  0.00           H  
HETATM   40  H6  UNL     1      -1.107   0.684  -3.190  1.00  0.00           H  
HETATM   41  H7  UNL     1      -0.230   2.305  -4.308  1.00  0.00           H  
HETATM   42  H8  UNL     1      -1.998   5.318  -3.437  1.00  0.00           H  
HETATM   43  H9  UNL     1      -4.274   6.121  -1.580  1.00  0.00           H  
HETATM   44  H10 UNL     1      -3.125   3.929   0.384  1.00  0.00           H  
HETATM   45  H11 UNL     1      -2.689   0.030  -1.063  1.00  0.00           H  
HETATM   46  H12 UNL     1      -3.198  -2.059  -0.343  1.00  0.00           H  
HETATM   47  H13 UNL     1      -4.075  -4.134   0.598  1.00  0.00           H  
HETATM   48  H14 UNL     1      -1.963  -3.331   4.807  1.00  0.00           H  
HETATM   49  H15 UNL     1      -0.874  -1.680   5.068  1.00  0.00           H  
HETATM   50  H16 UNL     1      -0.798   0.346   2.136  1.00  0.00           H  
HETATM   51  H17 UNL     1       3.205   0.335  -0.636  1.00  0.00           H  
HETATM   52  H18 UNL     1       3.432  -0.624  -2.816  1.00  0.00           H  
HETATM   53  H19 UNL     1       3.034  -2.714  -0.991  1.00  0.00           H  
HETATM   54  H20 UNL     1       4.828  -2.203  -2.192  1.00  0.00           H  
HETATM   55  H21 UNL     1       4.648  -1.112   0.992  1.00  0.00           H  
HETATM   56  H22 UNL     1       5.137  -3.156   1.465  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   35
CONECT    4    5   33   36
CONECT    5    6
CONECT    6    7   29   37
CONECT    7    8
CONECT    8    9   19   38
CONECT    9   10   39   40
CONECT   10   11   11   17
CONECT   11   12   13
CONECT   12   41
CONECT   13   14   14   42
CONECT   14   15   16
CONECT   15   43
CONECT   16   17   17   44
CONECT   17   18
CONECT   18   19
CONECT   19   20   45
CONECT   20   21   21   28
CONECT   21   22   46
CONECT   22   23   24   24
CONECT   23   47
CONECT   24   25   26
CONECT   25   48
CONECT   26   27   28   28
CONECT   27   49
CONECT   28   50
CONECT   29   30   31   51
CONECT   30   52
CONECT   31   32   33   53
CONECT   32   54
CONECT   33   34   55
CONECT   34   56
END

HMDB0041639
     RDKit          3D
(-)-Epigallocatechin 3-glucuronide
 56 59  0  0  0  0  0  0  0  0999 V2000
    3.8377    0.3303    2.5940 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7959    0.0479    1.9416 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9281    1.0825    1.6631 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6085   -1.3652    1.5411 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4566   -1.4900    0.8213 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3629   -0.8456   -0.3708 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5146    0.2251   -0.3449 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5940    0.1169   -1.1424 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.6304    1.1157   -2.2603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3293    2.3712   -1.9810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3465    3.3591   -2.9187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7056    3.1732   -4.1289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0033    4.5611   -2.6775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6592    4.8014   -1.4891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2960    6.0167   -1.3044 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6242    3.7840   -0.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9689    2.5754   -0.7924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9447    1.5671    0.1506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8413    0.2213   -0.3286 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9870   -0.7476    0.7563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7266   -1.9086    0.6411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8669   -2.8054    1.6641 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6189   -3.9469    1.4869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2662   -2.5917    2.8840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4074   -3.5039    3.9288 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5198   -1.4461    3.0405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8798   -1.1516    4.2366 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3910   -0.5424    1.9772 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7065   -0.5577   -1.0068 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5349   -0.5143   -2.3915 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5669   -1.7743   -0.7064 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.7973   -1.7010   -1.3496 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8106   -1.8246    0.7722 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1646   -3.1069    1.2020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3300    1.4561    2.3848 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5194   -1.9499    2.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8828   -1.5894   -1.0865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5718   -0.8955   -1.6490 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4087    1.3987   -2.5997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1070    0.6836   -3.1897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2300    2.3051   -4.3078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9976    5.3181   -3.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2742    6.1214   -1.5803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1249    3.9289    0.3842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6887    0.0301   -1.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1980   -2.0594   -0.3427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0747   -4.1337    0.5982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9631   -3.3305    4.8069 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8740   -1.6798    5.0681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7978    0.3457    2.1361 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2048    0.3346   -0.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4324   -0.6237   -2.8157 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0339   -2.7145   -0.9908 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8277   -2.2032   -2.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6476   -1.1120    0.9921 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1365   -3.1557    1.4645 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  1  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 22 24  2  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  2  0
  6 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33  4  1  0
 19  8  1  0
 28 20  1  0
 17 10  1  0
  3 35  1  0
  4 36  1  1
  6 37  1  6
  8 38  1  6
  9 39  1  0
  9 40  1  0
 12 41  1  0
 13 42  1  0
 15 43  1  0
 16 44  1  0
 19 45  1  6
 21 46  1  0
 23 47  1  0
 25 48  1  0
 27 49  1  0
 28 50  1  0
 29 51  1  1
 30 52  1  0
 31 53  1  6
 32 54  1  0
 33 55  1  6
 34 56  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Value	Source
(-)-Epigallocatechin 3-O-glucuronide	HMDB
(2S,3S,4S,5R,6R)-6-{[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylate	HMDB

Chemical Formula

C₂₁H₂₂O₁₃

Average Molecular Weight

482.3916

Monoisotopic Molecular Weight

482.10604079

IUPAC Name

(2S,3S,4S,5R,6R)-6-{[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

Traditional Name

(2S,3S,4S,5R,6R)-6-{[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

CAS Registry Number

Not Available

SMILES

O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CC3=C(O[C@@H]2C2=CC(O)=C(O)C(O)=C2)C=C(O)C=C3O)O[C@@H]([C@H]1O)C(O)=O

InChI Identifier

InChI=1S/C21H22O13/c22-7-3-9(23)8-5-13(33-21-17(29)15(27)16(28)19(34-21)20(30)31)18(32-12(8)4-7)6-1-10(24)14(26)11(25)2-6/h1-4,13,15-19,21-29H,5H2,(H,30,31)/t13-,15+,16+,17-,18-,19+,21-/m1/s1

InChI Key

ZTOAOZDTXSRHIB-BBGDWMAASA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-3-O-glycosides

Alternative Parents

Substituents

Flavonoid-3-o-glycoside
3'-hydroxyflavonoid
4'-hydroxyflavonoid
5-hydroxyflavonoid
7-hydroxyflavonoid
Flavone
Hydroxyflavonoid
Chromone
Glycosyl compound
O-glycosyl compound
Benzopyran
1-benzopyran
Benzenetriol
Pyrogallol derivative
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Phenol
Pyranone
Oxane
Pyran
Monocyclic benzene moiety
Monosaccharide
Benzenoid
Heteroaromatic compound
Vinylogous acid
Secondary alcohol
Oxacycle
Acetal
Polyol
Organoheterocyclic compound
Organooxygen compound
Hydrocarbon derivative
Alcohol
Organic oxygen compound
Organic oxide
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Non-excretory biofluid

Biofluid or Excreta

Blood (HMDB: HMDB0041639)

Organ

Liver (HMDB: HMDB0041639)
Kidney (HMDB: HMDB0041639)

Excreta

Biofluid or Excreta

Urine (PMID: 20080030)

Cellular substructure

Extracellular (HMDB: HMDB0041639)
Cytoplasm (HMDB: HMDB0041639)

Source

Endogenous

Endogenous (HMDB: HMDB0041639)

Plant

Plant (HMDB: HMDB0041639)

Exogenous

Food

Food (HMDB: HMDB0041639)

Cocoa and cocoa product

Cocoa and cocoa products (HMDB: HMDB0041639)

Tea

Tea products (HMDB: HMDB0041639)

Nut

Nuts (HMDB: HMDB0041639)

Beverage

Alcoholic beverage

Red wine (HMDB: HMDB0041639)

Fruit

Berries (HMDB: HMDB0041639)

Pome

Apple (HMDB: HMDB0041639)

Exogenous (HMDB: HMDB0041639)

Process

Not Available

Role

Biological role

Waste product (HMDB: HMDB0041639)

Physical Properties

State

Not Available

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	3.7 g/L	ALOGPS
logP	1.05	ALOGPS
logP	0.041	ChemAxon
logS	-2.1	ALOGPS
pKa (Strongest Acidic)	2.89	ChemAxon
pKa (Strongest Basic)	-3.9	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	13	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	226.83 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	108.26 m³·mol⁻¹	ChemAxon
Polarizability	43.99 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	208.169	31661259
DarkChem	[M-H]-	203.074	31661259
DeepCCS	[M+H]+	203.635	30932474
DeepCCS	[M-H]-	201.418	30932474
DeepCCS	[M-2H]-	234.825	30932474
DeepCCS	[M+Na]+	209.416	30932474
AllCCS	[M+H]+	208.5	32859911
AllCCS	[M+H-H2O]+	206.3	32859911
AllCCS	[M+NH4]+	210.4	32859911
AllCCS	[M+Na]+	211.0	32859911
AllCCS	[M-H]-	204.8	32859911
AllCCS	[M+Na-2H]-	205.4	32859911
AllCCS	[M+HCOO]-	206.2	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
(-)-Epigallocatechin 3-glucuronide	O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CC3=C(O[C@@H]2C2=CC(O)=C(O)C(O)=C2)C=C(O)C=C3O)O[C@@H]([C@H]1O)C(O)=O	6049.7	Standard polar	33892256
(-)-Epigallocatechin 3-glucuronide	O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CC3=C(O[C@@H]2C2=CC(O)=C(O)C(O)=C2)C=C(O)C=C3O)O[C@@H]([C@H]1O)C(O)=O	4168.1	Standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide	O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CC3=C(O[C@@H]2C2=CC(O)=C(O)C(O)=C2)C=C(O)C=C3O)O[C@@H]([C@H]1O)C(O)=O	4567.7	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #1	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@@H]1O	4375.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](C(=O)O)O[C@H]1O[C@@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC(O)=C(O)C(O)=C1	4392.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #3	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4327.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #4	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	4282.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #5	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4377.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #6	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4333.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	4386.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4332.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	4313.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4279.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #11	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4300.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #12	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4263.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #13	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	4208.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4230.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #15	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4221.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #16	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4231.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #17	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4266.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #18	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4234.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #19	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4195.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4302.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4175.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4155.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #22	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4195.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #23	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)C=C1O	4212.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #24	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4249.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #25	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4277.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #26	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4307.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #27	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4241.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #28	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4286.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #29	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4313.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4261.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #4	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4280.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #5	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	4238.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #6	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	4183.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #7	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@@H]1O[Si](C)(C)C	4312.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	4322.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4313.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4216.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #10	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4075.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #11	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4208.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #12	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4144.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #13	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4166.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #14	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	4091.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #15	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4014.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #16	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4095.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #17	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4030.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4185.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #19	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O)=C1O	4135.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4182.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #20	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4092.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #21	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4061.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #22	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)C=C1O	4085.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #23	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4247.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #24	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4196.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #25	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4214.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #26	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O)=C1O	4165.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #27	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)C=C1O	4120.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #28	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4165.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #29	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4185.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4197.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #30	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4140.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #31	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4095.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #32	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4156.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #33	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4111.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #34	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4043.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4113.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #36	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4045.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #37	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4116.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #38	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4083.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #39	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	4070.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #4	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O)=C1O	4148.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4074.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #41	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4057.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #42	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4090.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #43	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4127.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #44	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4079.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #45	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4127.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #46	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4072.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #47	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4049.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #48	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4093.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #49	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4063.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #5	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)C=C1O	4095.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #50	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4148.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #51	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4127.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #52	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4099.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #53	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4105.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #54	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4037.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #55	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4049.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #56	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4061.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #57	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4032.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #58	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4054.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #59	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4105.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@@H]1O[Si](C)(C)C	4213.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #60	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4134.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #61	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4170.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #62	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4194.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #63	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4179.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #7	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4154.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4175.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4119.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4127.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4050.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #11	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3990.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4146.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #13	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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[Si](C)(C)C)=CC(O)=C1O	4092.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #14	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O	4045.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #15	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O)=C1O[Si](C)(C)C	4025.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #16	C[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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[Si](C)(C)C)C=C1O	4034.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #17	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4052.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #18	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3982.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #19	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3939.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4146.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #20	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4113.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #21	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3996.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #22	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3973.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #23	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4130.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #24	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3994.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #25	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3977.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #26	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4070.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #27	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4020.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #28	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4075.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #29	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3971.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4085.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #30	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3986.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #31	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[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)=CC(O)=C1O	4022.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	3963.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #33	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	3980.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #34	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3962.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3989.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #36	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3970.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #37	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4037.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #38	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3980.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #39	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O	4033.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #4	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4033.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #40	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O)=C1O[Si](C)(C)C	4013.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #41	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4016.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #42	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4153.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #43	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4169.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #44	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4112.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #45	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4062.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #46	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4103.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #47	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[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)=CC(O)=C1O	4049.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #48	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	3992.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #49	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4065.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4188.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #50	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4008.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #51	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O	4058.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #52	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O)=C1O[Si](C)(C)C	4041.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #53	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4082.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #54	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4011.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #55	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3959.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #56	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4026.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #57	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3979.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #58	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4021.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #59	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4003.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #6	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4093.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #60	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3997.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #61	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3991.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #62	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4002.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #63	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3981.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #64	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4015.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #65	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3990.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #66	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4036.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #67	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3966.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #68	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	4013.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #69	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	4014.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #7	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4127.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #70	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3996.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #71	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4024.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #72	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3979.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #73	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4025.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #74	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3957.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #75	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3997.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #76	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4033.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #77	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3972.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #78	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3952.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #79	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4024.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #8	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[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)=CC(O)=C1O	4036.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #80	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4020.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #81	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3996.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #82	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4022.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #83	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3997.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #84	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4032.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #85	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4012.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #86	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4048.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #87	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3982.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #88	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3999.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #89	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3991.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #9	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	3979.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #90	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3970.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,4TMS,isomer #91	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4093.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #1	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4019.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #10	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4061.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #11	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4007.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #12	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	4051.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #13	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3960.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #14	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3971.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #15	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[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[Si](C)(C)C)=CC(O)=C1O	4000.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #16	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	3974.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #17	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O	3977.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3970.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #19	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3985.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #2	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3966.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3977.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4018.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #22	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3984.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #23	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4016.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #24	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4007.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #25	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4006.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #26	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3921.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #27	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3945.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #28	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4001.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #29	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3936.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #3	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3960.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #30	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3930.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #31	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3954.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #32	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3955.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #33	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3950.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #34	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3946.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #35	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3972.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #36	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3974.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #37	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3955.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #38	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3977.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #39	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3973.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #4	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4114.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #40	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3941.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #41	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3962.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #42	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3956.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #43	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3948.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #44	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O	3958.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #45	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3953.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #46	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)[C@@H](C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3960.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #47	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3968.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #48	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3972.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #49	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3966.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #5	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3983.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #50	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3992.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #51	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4042.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #52	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3992.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #53	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3979.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #54	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4009.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #55	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3996.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #56	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4012.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #57	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4005.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #58	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3965.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #59	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3985.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #6	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3976.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #60	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O	3980.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #61	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3975.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #62	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3994.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #63	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3989.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #64	C[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[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)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4019.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #65	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3943.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #66	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3960.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #67	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3958.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #68	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3952.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #69	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3978.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #7	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4126.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #70	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3971.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #71	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3996.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #72	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3971.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #73	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3959.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #74	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)[C@@H](C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	3983.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #75	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)[C@@H](C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3993.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #76	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3959.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #77	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3945.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #78	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3957.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #79	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3992.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #8	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3989.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #80	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3973.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #81	C[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3986.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #82	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3973.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #83	C[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4005.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #84	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3984.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #85	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3973.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #86	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3963.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #87	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3973.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #88	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3964.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #89	C[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)[C@@H](C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4002.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #9	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3981.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #90	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3999.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,5TMS,isomer #91	C[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3965.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@@H]1O	4604.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](C(=O)O)O[C@H]1O[C@@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC(O)=C(O)C(O)=C1	4619.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4590.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	4577.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4599.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4581.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	4608.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4624.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4700.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4684.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4692.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4666.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4643.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4624.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4608.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4678.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4658.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4639.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4620.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4711.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4626.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	4592.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4663.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)C=C1O	4638.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4637.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4705.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4684.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4678.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4671.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4748.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4661.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4671.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O	4642.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O	4618.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@@H]1O[Si](C)(C)C(C)(C)C	4716.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4720.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4755.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	4813.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4696.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4813.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4697.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4750.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O	4656.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	4666.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4678.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4716.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4762.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4716.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4747.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4685.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4666.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4697.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4862.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2	4769.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4784.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4736.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4723.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4790.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4812.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)OC2=C1	4759.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4753.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4740.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4727.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4690.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)[C@@H](C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	4701.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4713.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)[C@@H](C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4741.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4727.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4709.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4682.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O	4708.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4714.1	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4705.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4722.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4700.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4689.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4679.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4687.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C1)O2	4668.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4718.4	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4711.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=C(O)C=C([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O	4694.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4746.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4710.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4693.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O[Si](C)(C)C(C)(C)C	4713.7	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4744.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4749.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4728.3	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #57	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4703.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #58	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	4684.2	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #59	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4728.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C(=O)O)O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@@H]1O[Si](C)(C)C(C)(C)C	4807.6	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #60	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4745.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #61	CC(C)(C)[Si](C)(C)OC1=CC2=C(C[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)[C@@H](C3=CC(O)=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4725.0	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #62	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4805.5	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #63	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4785.9	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4743.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4768.8	Semi standard non polar	33892256
(-)-Epigallocatechin 3-glucuronide,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC(=O)[C@H]1O[C@@H](O[C@@H]2CC3=C(O)C=C(O)C=C3O[C@@H]2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4708.3	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 - (-)-Epigallocatechin 3-glucuronide GC-MS (Non-derivatized) - 70eV, Positive	splash10-0bt9-9106300000-552f6ab3cff61b7abb97	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (3 TMS) - 70eV, Positive	splash10-001i-3372129000-3f8dcfea2d221f87f6ee	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_3_19) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_4_13) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_4_31) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_4_39) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_4_40) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_5_15) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_5_23) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_5_24) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_5_44) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (TMS_5_50) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (-)-Epigallocatechin 3-glucuronide GC-MS ("(-)-Epigallocatechin 3-glucuronide,3TMS,#19" TMS) - 70eV, Positive	Not Available	2021-10-14	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 - (-)-Epigallocatechin 3-glucuronide 10V, Positive-QTOF	splash10-052r-0914600000-c39b886d397274aa8aab	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 20V, Positive-QTOF	splash10-059i-0922000000-4de1b6b85fd8744dc69f	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 40V, Positive-QTOF	splash10-0079-1900000000-4cf9036d71c53dacf819	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 10V, Negative-QTOF	splash10-053r-1304900000-446f5d442ea29d91a350	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 20V, Negative-QTOF	splash10-0a4i-2729500000-01d07573e50e75351131	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 40V, Negative-QTOF	splash10-056r-3913000000-25aa7776faf06e9d1e6d	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 10V, Negative-QTOF	splash10-01q9-0001900000-4f187db62e9c12f91263	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 20V, Negative-QTOF	splash10-057i-8519600000-3fb6ec1f08f8cce621d1	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 40V, Negative-QTOF	splash10-052u-8569300000-38b7259de1fc36026007	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 10V, Positive-QTOF	splash10-001i-0001900000-5397aa7c48e51423d07f	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 20V, Positive-QTOF	splash10-0aor-0103900000-34b3c6d2aada810dff16	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (-)-Epigallocatechin 3-glucuronide 40V, Positive-QTOF	splash10-0670-1922200000-23a0641628e7027c7e8c	2021-09-24	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Blood
Urine

Tissue Locations

Kidney
Liver

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Normal	Not Available	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 780	20080030	details

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

FDB029794

KNApSAcK ID

Not Available

Chemspider ID

30777584

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

101449862

PDB ID

Not Available

ChEBI ID

168759

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

Neveu V, Perez-Jimenez J, Vos F, Crespy V, du Chaffaut L, Mennen L, Knox C, Eisner R, Cruz J, Wishart D, Scalbert A: Phenol-Explorer: an online comprehensive database on polyphenol contents in foods. Database (Oxford). 2010;2010:bap024. doi: 10.1093/database/bap024. Epub 2010 Jan 8. [PubMed:20428313 ]

Showing metabocard for (-)-Epigallocatechin 3-glucuronide (HMDB0041639)

MOL for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

3D MOL for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

3D SDF for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

3D-SDF for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

PDB for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

3D PDB for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

SMILES for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

INCHI for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

Structure for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

3D Structure for HMDB0041639 ((-)-Epigallocatechin 3-glucuronide)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra