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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2021-09-23 03:47:25 UTC

Update Date

2021-09-23 03:47:25 UTC

HMDB ID

HMDB0301935

Secondary Accession Numbers

None

Metabolite Identification

Common Name

ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin

Description

Ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin is a member of the class of compounds known as biflavonoids and polyflavonoids. Biflavonoids and polyflavonoids are organic compounds containing at least two flavan/flavone units. These units are usually linked through CC or C-O-C bonds. Some examples include C2-O-C3, C2-O-C4, C3'-C3''', and C6-C8''. Ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin can be found in peach, which makes ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin a potential biomarker for the consumption of this food product.

Structure

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


  Mrv0541 02241212192D          

 41 47  0  0  0  0            999 V2000
   -4.3313    1.2964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0457    0.8839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.6168    0.0589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6168    0.8839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9023    1.2964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1879    0.0589    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1879    0.8839    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4734    1.2964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1959   -0.2501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9023   -0.3536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
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  7  6  1  0  0  0  0
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  5 41  1  0  0  0  0
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 35 36  1  0  0  0  0
 31 39  1  0  0  0  0
  9 40  1  6  0  0  0
 20 41  1  6  0  0  0
M  END

HMDB0301935
     RDKit          3D
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin
 65 71  0  0  0  0  0  0  0  0999 V2000
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 41 65  1  0
M  END


  Mrv0541 02241212192D          

 41 47  0  0  0  0            999 V2000
   -4.3313    1.2964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0457    0.8839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  7  6  1  0  0  0  0
  6  5  2  0  0  0  0
  5 41  1  0  0  0  0
  7  9  1  0  0  0  0
 41  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  1  0  0  0
 12 10  2  0  0  0  0
 10 13  1  0  0  0  0
 11 12  1  0  0  0  0
 11 15  2  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
  8 17  1  1  0  0  0
  4 18  1  0  0  0  0
  2 19  1  0  0  0  0
 20 21  2  0  0  0  0
 20 25  1  0  0  0  0
 21 22  1  0  0  0  0
 21 40  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 38  1  0  0  0  0
 25 24  2  0  0  0  0
 24 27  1  0  0  0  0
 26 25  1  0  0  0  0
 26 29  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 37  1  6  0  0  0
 29 30  1  1  0  0  0
 32 30  2  0  0  0  0
 30 33  1  0  0  0  0
 31 32  1  0  0  0  0
 31 35  2  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 31 39  1  0  0  0  0
  9 40  1  6  0  0  0
 20 41  1  6  0  0  0
M  END
> <DATABASE_ID>
HMDB0301935

> <DATABASE_NAME>
hmdb

> <SMILES>
O[C@H]1CC2=C(O[C@@H]1C1=CC(O)=C(O)C=C1)C1=C(O[C@]3(OC4=C(C1[C@@H]3O)C(O)=CC(O)=C4)C1=CC=C(O)C=C1)C=C2O

> <INCHI_IDENTIFIER>
InChI=1S/C30H24O11/c31-14-4-2-13(3-5-14)30-29(38)26(24-20(36)8-15(32)9-22(24)40-30)25-23(41-30)11-18(34)16-10-21(37)27(39-28(16)25)12-1-6-17(33)19(35)7-12/h1-9,11,21,26-27,29,31-38H,10H2/t21-,26?,27+,29-,30+/m0/s1

> <INCHI_KEY>
MXKKFADFYXJREN-YBYURAQPSA-N

> <FORMULA>
C30H24O11

> <MOLECULAR_WEIGHT>
560.505

> <EXACT_MASS>
560.13186161

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
55.50080387473864

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
8

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(5R,6S,13R,21S)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15(20),16,18-hexaene-6,9,17,19,21-pentol

> <ALOGPS_LOGP>
2.61

> <JCHEM_LOGP>
3.8940974183333332

> <ALOGPS_LOGS>
-3.80

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.187769053046475

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.748166891541448

> <JCHEM_PKA_STRONGEST_BASIC>
-3.2931729512486445

> <JCHEM_POLAR_SURFACE_AREA>
189.52999999999997

> <JCHEM_REFRACTIVITY>
142.21540000000005

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
8.89e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(5R,6S,13R,21S)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15(20),16,18-hexaene-6,9,17,19,21-pentol

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0301935
     RDKit          3D
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin
 65 71  0  0  0  0  0  0  0  0999 V2000
   -6.0784    5.2234   -0.1249 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2766    4.0903   -0.1485 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6197    3.7554   -1.3076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8246    2.6265   -1.3049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7006    1.8547   -0.1554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8450    0.6388   -0.1280 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7297   -0.4302    0.3123 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1590   -1.6551    0.6191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0101   -2.7261    0.6996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5279   -3.9700    1.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3909   -5.0586    1.0912 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1885   -4.0743    1.2243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3044   -2.9629    1.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0004   -3.2784    1.4031 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7822   -1.7225    0.8297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8729   -0.5677    0.7207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2204   -0.4278   -0.6031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0387   -0.0322   -1.6453 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5064    0.1058   -2.8998 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8287   -0.1408   -3.1283 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3894   -0.0092   -4.3906 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6629   -0.5379   -2.0787 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1085   -0.6689   -0.8356 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9546   -1.0485    0.1867 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3029   -1.4024    0.1059 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1357   -0.3742    0.7764 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9753   -0.7531    1.8204 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7809    0.1706    2.4680 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7747    1.5059    2.0940 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5722    2.4413    2.7327 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9366    1.8681    1.0538 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9255    3.2116    0.6705 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1297    0.9435    0.4061 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7491   -1.6588   -1.3046 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5907   -2.9989   -1.6289 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0906   -0.8052   -2.3388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4030    0.2319   -1.4007 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6977    0.7456    0.8270 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.0842    0.9366    2.1406 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3592    2.1846    1.0111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1507    3.3171    0.9978 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0649    5.0636   -0.3896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7405    4.3820   -2.1768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2974    2.3565   -2.2174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0794   -2.6076    0.5203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3690   -4.9136    0.9233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8171   -5.0619    1.4703 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8293   -2.8191    1.4812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1268   -0.5186    1.5444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1553    0.4202   -3.7190 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3396   -0.1671   -4.6448 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3938   -2.3882    0.6377 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0290   -1.7776    2.1676 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4116   -0.1577    3.2747 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1833    2.1537    3.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3569    3.5790   -0.0768 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000    1.3265   -0.3998 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8584   -1.4654   -1.3242 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2404   -3.1230   -2.5411 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6801    0.1503   -2.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1988   -1.3876   -3.3128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0178    1.5386    0.4693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5270    1.6859    2.5131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2875    1.5937    1.9333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6755    3.5895    1.9143 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  6  5  1  6
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12 13  1  0
 13 14  1  0
 13 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  2  0
 25 34  1  0
 34 35  1  0
 34 36  1  0
 18 37  1  0
 16 38  1  0
 38 39  1  0
  5 40  1  0
 40 41  2  0
 41  2  1  0
 37  6  1  0
 38  6  1  0
 15  8  1  0
 23 17  1  0
 33 26  1  0
 36 22  1  0
  1 42  1  0
  3 43  1  0
  4 44  1  0
  9 45  1  0
 11 46  1  0
 12 47  1  0
 14 48  1  0
 16 49  1  0
 19 50  1  0
 21 51  1  0
 25 52  1  1
 27 53  1  0
 28 54  1  0
 30 55  1  0
 32 56  1  0
 33 57  1  0
 34 58  1  1
 35 59  1  0
 36 60  1  0
 36 61  1  0
 38 62  1  6
 39 63  1  0
 40 64  1  0
 41 65  1  0
M  END

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -8.085   2.420   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -9.419   1.650   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -9.419   0.110   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -8.085  -0.660   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -6.751   0.110   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -6.751   1.650   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      -5.418   2.420   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0      -4.084   0.110   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -4.084   1.650   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -2.750   2.420   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -1.417   4.730   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -2.750   3.960   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -1.417   1.650   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -0.083   2.420   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.083   3.960   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0       1.251   4.730   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0      -2.750  -0.660   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0      -8.085  -2.200   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0     -10.752   2.420   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0      -1.699  -2.777   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -0.366  -2.007   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       0.968  -2.777   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       0.968  -4.317   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -0.365  -5.087   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -1.699  -4.317   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      -3.033  -5.087   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      -0.365  -6.627   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -1.699  -7.397   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      -3.033  -6.627   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      -4.367  -7.397   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -7.034  -7.397   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      -5.700  -6.627   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      -4.367  -8.937   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      -5.700  -9.707   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      -7.034  -8.937   0.000  0.00  0.00           C+0
HETATM   36  O   UNK     0      -8.368  -9.707   0.000  0.00  0.00           O+0
HETATM   37  O   UNK     0      -1.699  -8.937   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       2.302  -5.087   0.000  0.00  0.00           O+0
HETATM   39  O   UNK     0      -8.368  -6.627   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0      -0.366  -0.467   0.000  0.00  0.00           O+0
HETATM   41  C   UNK     0      -5.418  -0.660   0.000  0.00  0.00           C+0
CONECT    1    2    6                                                       
CONECT    2    1    3   19                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   18                                                  
CONECT    5    4    6   41                                                  
CONECT    6    1    7    5                                                  
CONECT    7    6    9                                                       
CONECT    8   41    9   17                                                  
CONECT    9    7    8   10   40                                             
CONECT   10    9   12   13                                                  
CONECT   11   12   15                                                       
CONECT   12   10   11                                                       
CONECT   13   10   14                                                       
CONECT   14   13   15                                                       
CONECT   15   11   14   16                                                  
CONECT   16   15                                                            
CONECT   17    8                                                            
CONECT   18    4                                                            
CONECT   19    2                                                            
CONECT   20   21   25   41                                                  
CONECT   21   20   22   40                                                  
CONECT   22   21   23                                                       
CONECT   23   22   24   38                                                  
CONECT   24   23   25   27                                                  
CONECT   25   20   24   26                                                  
CONECT   26   25   29                                                       
CONECT   27   24   28                                                       
CONECT   28   27   29   37                                                  
CONECT   29   26   28   30                                                  
CONECT   30   29   32   33                                                  
CONECT   31   32   35   39                                                  
CONECT   32   30   31                                                       
CONECT   33   30   34                                                       
CONECT   34   33   35                                                       
CONECT   35   31   34   36                                                  
CONECT   36   35                                                            
CONECT   37   28                                                            
CONECT   38   23                                                            
CONECT   39   31                                                            
CONECT   40   21    9                                                       
CONECT   41    5    8   20                                                  
MASTER        0    0    0    0    0    0    0    0   41    0   94    0
END

COMPND    HMDB0301935
HETATM    1  O1  UNL     1      -6.078   5.223  -0.125  1.00  0.00           O  
HETATM    2  C1  UNL     1      -5.277   4.090  -0.148  1.00  0.00           C  
HETATM    3  C2  UNL     1      -4.620   3.755  -1.308  1.00  0.00           C  
HETATM    4  C3  UNL     1      -3.825   2.626  -1.305  1.00  0.00           C  
HETATM    5  C4  UNL     1      -3.701   1.855  -0.155  1.00  0.00           C  
HETATM    6  C5  UNL     1      -2.845   0.639  -0.128  1.00  0.00           C  
HETATM    7  O2  UNL     1      -3.730  -0.430   0.312  1.00  0.00           O  
HETATM    8  C6  UNL     1      -3.159  -1.655   0.619  1.00  0.00           C  
HETATM    9  C7  UNL     1      -4.010  -2.726   0.700  1.00  0.00           C  
HETATM   10  C8  UNL     1      -3.528  -3.970   1.008  1.00  0.00           C  
HETATM   11  O3  UNL     1      -4.391  -5.059   1.091  1.00  0.00           O  
HETATM   12  C9  UNL     1      -2.188  -4.074   1.224  1.00  0.00           C  
HETATM   13  C10 UNL     1      -1.304  -2.963   1.140  1.00  0.00           C  
HETATM   14  O4  UNL     1      -0.000  -3.278   1.403  1.00  0.00           O  
HETATM   15  C11 UNL     1      -1.782  -1.722   0.830  1.00  0.00           C  
HETATM   16  C12 UNL     1      -0.873  -0.568   0.721  1.00  0.00           C  
HETATM   17  C13 UNL     1      -0.220  -0.428  -0.603  1.00  0.00           C  
HETATM   18  C14 UNL     1      -1.039  -0.032  -1.645  1.00  0.00           C  
HETATM   19  C15 UNL     1      -0.506   0.106  -2.900  1.00  0.00           C  
HETATM   20  C16 UNL     1       0.829  -0.141  -3.128  1.00  0.00           C  
HETATM   21  O5  UNL     1       1.389  -0.009  -4.391  1.00  0.00           O  
HETATM   22  C17 UNL     1       1.663  -0.538  -2.079  1.00  0.00           C  
HETATM   23  C18 UNL     1       1.109  -0.669  -0.836  1.00  0.00           C  
HETATM   24  O6  UNL     1       1.955  -1.049   0.187  1.00  0.00           O  
HETATM   25  C19 UNL     1       3.303  -1.402   0.106  1.00  0.00           C  
HETATM   26  C20 UNL     1       4.136  -0.374   0.776  1.00  0.00           C  
HETATM   27  C21 UNL     1       4.975  -0.753   1.820  1.00  0.00           C  
HETATM   28  C22 UNL     1       5.781   0.171   2.468  1.00  0.00           C  
HETATM   29  C23 UNL     1       5.775   1.506   2.094  1.00  0.00           C  
HETATM   30  O7  UNL     1       6.572   2.441   2.733  1.00  0.00           O  
HETATM   31  C24 UNL     1       4.937   1.868   1.054  1.00  0.00           C  
HETATM   32  O8  UNL     1       4.925   3.212   0.671  1.00  0.00           O  
HETATM   33  C25 UNL     1       4.130   0.943   0.406  1.00  0.00           C  
HETATM   34  C26 UNL     1       3.749  -1.659  -1.305  1.00  0.00           C  
HETATM   35  O9  UNL     1       3.591  -2.999  -1.629  1.00  0.00           O  
HETATM   36  C27 UNL     1       3.091  -0.805  -2.339  1.00  0.00           C  
HETATM   37  O10 UNL     1      -2.403   0.232  -1.401  1.00  0.00           O  
HETATM   38  C28 UNL     1      -1.698   0.746   0.827  1.00  0.00           C  
HETATM   39  O11 UNL     1      -2.084   0.937   2.141  1.00  0.00           O  
HETATM   40  C29 UNL     1      -4.359   2.185   1.011  1.00  0.00           C  
HETATM   41  C30 UNL     1      -5.151   3.317   0.998  1.00  0.00           C  
HETATM   42  H1  UNL     1      -7.065   5.064  -0.390  1.00  0.00           H  
HETATM   43  H2  UNL     1      -4.740   4.382  -2.177  1.00  0.00           H  
HETATM   44  H3  UNL     1      -3.297   2.357  -2.217  1.00  0.00           H  
HETATM   45  H4  UNL     1      -5.079  -2.608   0.520  1.00  0.00           H  
HETATM   46  H5  UNL     1      -5.369  -4.914   0.923  1.00  0.00           H  
HETATM   47  H6  UNL     1      -1.817  -5.062   1.470  1.00  0.00           H  
HETATM   48  H7  UNL     1       0.829  -2.819   1.481  1.00  0.00           H  
HETATM   49  H8  UNL     1      -0.127  -0.519   1.544  1.00  0.00           H  
HETATM   50  H9  UNL     1      -1.155   0.420  -3.719  1.00  0.00           H  
HETATM   51  H10 UNL     1       2.340  -0.167  -4.645  1.00  0.00           H  
HETATM   52  H11 UNL     1       3.394  -2.388   0.638  1.00  0.00           H  
HETATM   53  H12 UNL     1       5.029  -1.778   2.168  1.00  0.00           H  
HETATM   54  H13 UNL     1       6.412  -0.158   3.275  1.00  0.00           H  
HETATM   55  H14 UNL     1       7.183   2.154   3.504  1.00  0.00           H  
HETATM   56  H15 UNL     1       4.357   3.579  -0.077  1.00  0.00           H  
HETATM   57  H16 UNL     1       3.500   1.327  -0.400  1.00  0.00           H  
HETATM   58  H17 UNL     1       4.858  -1.465  -1.324  1.00  0.00           H  
HETATM   59  H18 UNL     1       3.240  -3.123  -2.541  1.00  0.00           H  
HETATM   60  H19 UNL     1       3.680   0.150  -2.467  1.00  0.00           H  
HETATM   61  H20 UNL     1       3.199  -1.388  -3.313  1.00  0.00           H  
HETATM   62  H21 UNL     1      -1.018   1.539   0.469  1.00  0.00           H  
HETATM   63  H22 UNL     1      -1.527   1.686   2.513  1.00  0.00           H  
HETATM   64  H23 UNL     1      -4.288   1.594   1.933  1.00  0.00           H  
HETATM   65  H24 UNL     1      -5.676   3.590   1.914  1.00  0.00           H  
CONECT    1    2   42
CONECT    2    3    3   41
CONECT    3    4   43
CONECT    4    5    5   44
CONECT    5    6   40
CONECT    6    7   37   38
CONECT    7    8
CONECT    8    9    9   15
CONECT    9   10   45
CONECT   10   11   12   12
CONECT   11   46
CONECT   12   13   47
CONECT   13   14   15   15
CONECT   14   48
CONECT   15   16
CONECT   16   17   38   49
CONECT   17   18   18   23
CONECT   18   19   37
CONECT   19   20   20   50
CONECT   20   21   22
CONECT   21   51
CONECT   22   23   23   36
CONECT   23   24
CONECT   24   25
CONECT   25   26   34   52
CONECT   26   27   27   33
CONECT   27   28   53
CONECT   28   29   29   54
CONECT   29   30   31
CONECT   30   55
CONECT   31   32   33   33
CONECT   32   56
CONECT   33   57
CONECT   34   35   36   58
CONECT   35   59
CONECT   36   60   61
CONECT   38   39   62
CONECT   39   63
CONECT   40   41   41   64
CONECT   41   65
END

HMDB0301935
     RDKit          3D
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin
 65 71  0  0  0  0  0  0  0  0999 V2000
   -6.0784    5.2234   -0.1249 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2766    4.0903   -0.1485 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6197    3.7554   -1.3076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8246    2.6265   -1.3049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7006    1.8547   -0.1554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8450    0.6388   -0.1280 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7297   -0.4302    0.3123 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1590   -1.6551    0.6191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0101   -2.7261    0.6996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5279   -3.9700    1.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3909   -5.0586    1.0912 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1885   -4.0743    1.2243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3044   -2.9629    1.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0004   -3.2784    1.4031 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7822   -1.7225    0.8297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8729   -0.5677    0.7207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2204   -0.4278   -0.6031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0387   -0.0322   -1.6453 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5064    0.1058   -2.8998 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8287   -0.1408   -3.1283 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3894   -0.0092   -4.3906 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6629   -0.5379   -2.0787 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1085   -0.6689   -0.8356 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9546   -1.0485    0.1867 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3029   -1.4024    0.1059 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1357   -0.3742    0.7764 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9753   -0.7531    1.8204 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7809    0.1706    2.4680 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7747    1.5059    2.0940 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5722    2.4413    2.7327 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9366    1.8681    1.0538 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9255    3.2116    0.6705 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1297    0.9435    0.4061 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7491   -1.6588   -1.3046 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5907   -2.9989   -1.6289 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0906   -0.8052   -2.3388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4030    0.2319   -1.4007 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6977    0.7456    0.8270 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.0842    0.9366    2.1406 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3592    2.1846    1.0111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1507    3.3171    0.9978 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0649    5.0636   -0.3896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7405    4.3820   -2.1768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2974    2.3565   -2.2174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0794   -2.6076    0.5203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3690   -4.9136    0.9233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8171   -5.0619    1.4703 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8293   -2.8191    1.4812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1268   -0.5186    1.5444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1553    0.4202   -3.7190 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3396   -0.1671   -4.6448 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3938   -2.3882    0.6377 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0290   -1.7776    2.1676 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4116   -0.1577    3.2747 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1833    2.1537    3.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3569    3.5790   -0.0768 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000    1.3265   -0.3998 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8584   -1.4654   -1.3242 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2404   -3.1230   -2.5411 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6801    0.1503   -2.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1988   -1.3876   -3.3128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0178    1.5386    0.4693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5270    1.6859    2.5131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2875    1.5937    1.9333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6755    3.5895    1.9143 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  6  5  1  6
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12 13  1  0
 13 14  1  0
 13 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  2  0
 25 34  1  0
 34 35  1  0
 34 36  1  0
 18 37  1  0
 16 38  1  0
 38 39  1  0
  5 40  1  0
 40 41  2  0
 41  2  1  0
 37  6  1  0
 38  6  1  0
 15  8  1  0
 23 17  1  0
 33 26  1  0
 36 22  1  0
  1 42  1  0
  3 43  1  0
  4 44  1  0
  9 45  1  0
 11 46  1  0
 12 47  1  0
 14 48  1  0
 16 49  1  0
 19 50  1  0
 21 51  1  0
 25 52  1  1
 27 53  1  0
 28 54  1  0
 30 55  1  0
 32 56  1  0
 33 57  1  0
 34 58  1  1
 35 59  1  0
 36 60  1  0
 36 61  1  0
 38 62  1  6
 39 63  1  0
 40 64  1  0
 41 65  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Value	Source
ent-Epiafzelechin-(2a->7,4a->8)-catechin	Generator
ent-Epiafzelechin-(2α->7,4α->8)-catechin	Generator

Chemical Formula

C₃₀H₂₄O₁₁

Average Molecular Weight

560.505

Monoisotopic Molecular Weight

560.13186161

IUPAC Name

(5R,6S,13R,21S)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15(20),16,18-hexaene-6,9,17,19,21-pentol

Traditional Name

(5R,6S,13R,21S)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15(20),16,18-hexaene-6,9,17,19,21-pentol

CAS Registry Number

Not Available

SMILES

O[C@H]1CC2=C(O[C@@H]1C1=CC(O)=C(O)C=C1)C1=C(O[C@]3(OC4=C(C1[C@@H]3O)C(O)=CC(O)=C4)C1=CC=C(O)C=C1)C=C2O

InChI Identifier

InChI=1S/C30H24O11/c31-14-4-2-13(3-5-14)30-29(38)26(24-20(36)8-15(32)9-22(24)40-30)25-23(41-30)11-18(34)16-10-21(37)27(39-28(16)25)12-1-6-17(33)19(35)7-12/h1-9,11,21,26-27,29,31-38H,10H2/t21-,26?,27+,29-,30+/m0/s1

InChI Key

MXKKFADFYXJREN-YBYURAQPSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as biflavonoids and polyflavonoids. These are organic compounds containing at least two flavan/flavone units. These units are usually linked through CC or C-O-C bonds. Some examples include C2-O-C3, C2-O-C4, C3'-C3''', and C6-C8''.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Biflavonoids and polyflavonoids

Direct Parent

Biflavonoids and polyflavonoids

Alternative Parents

Substituents

A-type proanthocyanidin
Bi- and polyflavonoid skeleton
Proanthocyanidin
Catechin
Pyranoflavonoid
Flavan-3-ol
Hydroxyflavonoid
3'-hydroxyflavonoid
7-hydroxyflavonoid
5-hydroxyflavonoid
4'-hydroxyflavonoid
3-hydroxyflavonoid
Flavan
Pyranochromene
Chromane
1-benzopyran
Benzopyran
Catechol
Alkyl aryl ether
1-hydroxy-2-unsubstituted benzenoid
Phenol
Ketal
1-hydroxy-4-unsubstituted benzenoid
Benzenoid
Monocyclic benzene moiety
Secondary alcohol
Polyol
Acetal
Organoheterocyclic compound
Oxacycle
Ether
Hydrocarbon derivative
Alcohol
Organic oxygen compound
Organooxygen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Exogenous (HMDB: HMDB0301935)

Food

Fruit

Drupe

Peach (FooDB: FOOD00149)

Process

Not Available

Role

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
logP	2.61	ALOGPS
logP	3.89	ChemAxon
logS	-3.8	ALOGPS
pKa (Strongest Acidic)	8.75	ChemAxon
pKa (Strongest Basic)	-3.3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	11	ChemAxon
Hydrogen Donor Count	8	ChemAxon
Polar Surface Area	189.53 Å²	ChemAxon
Rotatable Bond Count	2	ChemAxon
Refractivity	142.22 m³·mol⁻¹	ChemAxon
Polarizability	55.5 Å³	ChemAxon
Number of Rings	7	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
AllCCS	[M+H]+	233.863	32859911
AllCCS	[M+H-H2O]+	232.137	32859911
AllCCS	[M+Na]+	235.88	32859911
AllCCS	[M+NH4]+	235.434	32859911
AllCCS	[M-H]-	226.53	32859911
AllCCS	[M+Na-2H]-	227.729	32859911
AllCCS	[M+HCOO]-	229.209	32859911
DeepCCS	[M+H]+	222.756	30932474
DeepCCS	[M-H]-	220.861	30932474
DeepCCS	[M-2H]-	254.168	30932474
DeepCCS	[M+Na]+	228.363	30932474

Predicted Kovats Retention Indices

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,1TMS,isomer #4	C[Si](C)(C)O[C@H]1C2C3=C(O)C=C(O)C=C3O[C@]1(C1=CC=C(O)C=C1)OC1=CC(O)=C3C[C@H](O)[C@@H](C4=CC=C(O)C(O)=C4)OC3=C12	5374.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,1TMS,isomer #4	C[Si](C)(C)O[C@H]1C2C3=C(O)C=C(O)C=C3O[C@]1(C1=CC=C(O)C=C1)OC1=CC(O)=C3C[C@H](O)[C@@H](C4=CC=C(O)C(O)=C4)OC3=C12	4747.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,1TMS,isomer #4	C[Si](C)(C)O[C@H]1C2C3=C(O)C=C(O)C=C3O[C@]1(C1=CC=C(O)C=C1)OC1=CC(O)=C3C[C@H](O)[C@@H](C4=CC=C(O)C(O)=C4)OC3=C12	7111.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #12	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	5274.5	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #12	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4805.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #12	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	6632.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #18	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	5299.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #18	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4801.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #18	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	6556.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #19	C[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5272.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #19	C[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4677.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #19	C[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	6537.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5289.6	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4739.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	6578.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #21	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5299.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #21	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4777.5	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #21	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	6431.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #22	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5242.3	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #22	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4695.4	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #22	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	6504.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #7	C[Si](C)(C)O[C@H]1CC2=C(O)C=C3O[C@@]4(C5=CC=C(O)C=C5)OC5=CC(O)=CC(O)=C5C(C3=C2O[C@@H]1C1=CC=C(O)C(O)=C1)[C@@H]4O[Si](C)(C)C	5318.5	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #7	C[Si](C)(C)O[C@H]1CC2=C(O)C=C3O[C@@]4(C5=CC=C(O)C=C5)OC5=CC(O)=CC(O)=C5C(C3=C2O[C@@H]1C1=CC=C(O)C(O)=C1)[C@@H]4O[Si](C)(C)C	4747.7	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TMS,isomer #7	C[Si](C)(C)O[C@H]1CC2=C(O)C=C3O[C@@]4(C5=CC=C(O)C=C5)OC5=CC(O)=CC(O)=C5C(C3=C2O[C@@H]1C1=CC=C(O)C(O)=C1)[C@@H]4O[Si](C)(C)C	6701.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #10	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	5173.4	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #10	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4782.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #10	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	6255.0	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #15	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	5164.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #15	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4789.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #15	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	6304.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O[Si](C)(C)C)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5166.3	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O[Si](C)(C)C)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4661.1	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O[Si](C)(C)C)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	6214.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5172.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4707.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	6253.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #21	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5191.0	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #21	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4756.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #21	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	6163.0	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #25	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	5086.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #25	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4725.1	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #25	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	6185.6	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #29	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	5092.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #29	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4688.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #29	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	6205.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5088.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4757.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	6248.4	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #35	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5126.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #35	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4805.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #35	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	6150.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #36	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	5150.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #36	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	4771.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #36	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	6133.4	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #40	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	5110.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #40	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4724.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #40	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	6138.2	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #43	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	5117.0	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #43	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4685.7	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #43	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	6157.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #45	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5114.5	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #45	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4753.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #45	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	6199.0	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #46	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5138.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #46	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4800.4	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #46	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	6116.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #47	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5109.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #47	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4623.4	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #47	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	6105.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #48	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5120.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #48	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4581.4	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #48	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	6091.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #49	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5148.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #49	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4664.5	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #49	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	6057.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #50	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5148.5	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #50	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4729.7	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #50	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	6090.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #51	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5120.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #51	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4642.4	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #51	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	6132.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #52	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5136.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #52	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4697.3	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #52	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	6052.2	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #6	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O[Si](C)(C)C)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5151.0	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #6	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O[Si](C)(C)C)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4671.7	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,3TMS,isomer #6	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O[Si](C)(C)C)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	6176.2	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #12	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O[Si](C)(C)C)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5023.4	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #12	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O[Si](C)(C)C)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4538.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #12	C[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O[Si](C)(C)C)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(C=C(O)C=C3O[Si](C)(C)C)O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5851.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5021.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4591.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5890.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #15	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5044.0	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #15	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4655.4	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #15	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5841.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #18	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4986.4	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #18	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4661.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #18	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	5932.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4990.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4721.7	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5971.2	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #24	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5016.5	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #24	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4767.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #24	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5913.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #25	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	5076.0	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #25	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	4753.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #25	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	5922.4	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #28	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4984.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #28	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4669.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #28	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	5971.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4986.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4729.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O[Si](C)(C)C)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	6010.6	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #31	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5023.0	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #31	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4779.7	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #31	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5943.2	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #33	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O[Si](C)(C)C)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5019.3	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #33	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O[Si](C)(C)C)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4585.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #33	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O[Si](C)(C)C)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5878.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #34	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5054.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #34	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4634.7	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #34	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5852.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #35	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5051.6	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #35	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4689.3	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #35	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O[Si](C)(C)C)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5882.2	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #38	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4882.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #38	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4582.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #38	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	5881.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #4	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4988.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #4	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4689.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #4	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	5907.9	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #41	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4881.4	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #41	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4644.4	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #41	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5920.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #44	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4914.6	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #44	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4701.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #44	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5862.1	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #45	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	4976.5	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #45	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	4671.5	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #45	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	5841.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #48	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O[Si](C)(C)C)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4876.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #48	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O[Si](C)(C)C)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4619.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #48	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O[Si](C)(C)C)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5897.6	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #50	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4915.3	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #50	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4664.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #50	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5867.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #51	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	4984.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #51	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	4632.3	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #51	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O[Si](C)(C)C	5854.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #53	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4917.5	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #53	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4726.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #53	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5896.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #54	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4985.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #54	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4698.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #54	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5889.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #55	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5007.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #55	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4738.3	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #55	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5844.9	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #58	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4899.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #58	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	4584.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #58	C[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O[Si](C)(C)C)=CC2=C3C3C4=C(C=C(O)C=C4O[Si](C)(C)C)O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)C=C1O	5842.4	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4899.3	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	4642.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=C4C[C@H](O)[C@@H](C5=CC=C(O[Si](C)(C)C)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C	5880.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #61	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4921.3	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #61	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4694.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #61	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5831.2	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #63	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O[Si](C)(C)C)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4888.3	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #63	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O[Si](C)(C)C)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4615.5	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #63	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O[Si](C)(C)C)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5859.9	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #64	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4924.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #64	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4657.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #64	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5836.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #65	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4928.4	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #65	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4717.3	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #65	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O[Si](C)(C)C)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5864.4	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #66	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O[Si](C)(C)C)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4929.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #66	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O[Si](C)(C)C)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	4498.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #66	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C1C3=C(C=C(O[Si](C)(C)C)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C	5791.0	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #67	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4960.4	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #67	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4588.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #67	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5789.7	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #68	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4963.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #68	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4560.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #68	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O[Si](C)(C)C)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5770.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #69	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4962.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #69	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	4613.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #69	C[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O[Si](C)(C)C)=CC(O)=C4C(C4=C(C=C(O[Si](C)(C)C)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C)C=C1	5798.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #9	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4984.9	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #9	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	4692.9	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,4TMS,isomer #9	C[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C)=CC=C1O	5944.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@H]1C2C3=C(O)C=C(O)C=C3O[C@]1(C1=CC=C(O)C=C1)OC1=CC(O)=C3C[C@H](O)[C@@H](C4=CC=C(O)C(O)=C4)OC3=C12	5596.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@H]1C2C3=C(O)C=C(O)C=C3O[C@]1(C1=CC=C(O)C=C1)OC1=CC(O)=C3C[C@H](O)[C@@H](C4=CC=C(O)C(O)=C4)OC3=C12	4982.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@H]1C2C3=C(O)C=C(O)C=C3O[C@]1(C1=CC=C(O)C=C1)OC1=CC(O)=C3C[C@H](O)[C@@H](C4=CC=C(O)C(O)=C4)OC3=C12	6986.0	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C(C)(C)C)=CC=C1O	5748.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C(C)(C)C)=CC=C1O	5221.0	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C(C)(C)C)=CC=C1O	6542.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C(C)(C)C)C=C1O	5770.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C(C)(C)C)C=C1O	5226.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC=C([C@H]2OC3=C(C[C@@H]2O)C(O)=CC2=C3C3C4=C(O)C=C(O)C=C4O[C@](C4=CC=C(O)C=C4)(O2)[C@H]3O[Si](C)(C)C(C)(C)C)C=C1O	6502.5	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C(C)(C)C	5727.7	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C(C)(C)C	5076.2	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C1C3=C(C=C(O)C4=C3O[C@H](C3=CC=C(O)C(O)=C3)[C@@H](O)C4)O[C@@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C(C)(C)C	6474.0	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C(C)(C)C	5748.4	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C(C)(C)C	5138.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)O[C@]1(C3=CC=C(O)C=C3)OC3=CC(O)=C4C[C@H](O)[C@@H](C5=CC=C(O)C(O)=C5)OC4=C3C2[C@@H]1O[Si](C)(C)C(C)(C)C	6506.3	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C(C)(C)C)C=C1	5767.1	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C(C)(C)C)C=C1	5189.6	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC=C([C@@]23OC4=CC(O)=CC(O)=C4C(C4=C(C=C(O)C5=C4O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)C5)O2)[C@@H]3O[Si](C)(C)C(C)(C)C)C=C1	6428.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C(C)(C)C	5728.2	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C(C)(C)C	5092.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC2=C(C3=C1C[C@H](O)[C@@H](C1=CC=C(O)C(O)=C1)O3)C1C3=C(O)C=C(O)C=C3O[C@](C3=CC=C(O)C=C3)(O2)[C@H]1O[Si](C)(C)C(C)(C)C	6449.8	Standard polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@H]1CC2=C(O)C=C3O[C@@]4(C5=CC=C(O)C=C5)OC5=CC(O)=CC(O)=C5C(C3=C2O[C@@H]1C1=CC=C(O)C(O)=C1)[C@@H]4O[Si](C)(C)C(C)(C)C	5762.8	Semi standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@H]1CC2=C(O)C=C3O[C@@]4(C5=CC=C(O)C=C5)OC5=CC(O)=CC(O)=C5C(C3=C2O[C@@H]1C1=CC=C(O)C(O)=C1)[C@@H]4O[Si](C)(C)C(C)(C)C	5164.8	Standard non polar	33892256
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@H]1CC2=C(O)C=C3O[C@@]4(C5=CC=C(O)C=C5)OC5=CC(O)=CC(O)=C5C(C3=C2O[C@@H]1C1=CC=C(O)C(O)=C1)[C@@H]4O[Si](C)(C)C(C)(C)C	6577.1	Standard polar	33892256

Spectra

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 10V, Positive-QTOF	splash10-03dl-1113390000-8e4c1dde10b9d9acb951	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 20V, Positive-QTOF	splash10-0a4l-1424940000-4132471214d329c47c74	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 40V, Positive-QTOF	splash10-0002-9412010000-398275f8f0e6dc21b904	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 10V, Negative-QTOF	splash10-0a4i-0110190000-44901bbf8647b9f7db75	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 20V, Negative-QTOF	splash10-0pbc-1921360000-14bb79c5fc2a2c9b0229	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 40V, Negative-QTOF	splash10-05di-0920000000-3def5e5ebd4ab57aa9b7	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 10V, Positive-QTOF	splash10-03di-0000090000-e26044261e1753b3f2e4	2021-10-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 20V, Positive-QTOF	splash10-03di-0000590000-e8e38a0336330046a7ea	2021-10-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 40V, Positive-QTOF	splash10-05fr-0410950000-7c5781f1439040ae4bc1	2021-10-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 10V, Negative-QTOF	splash10-0a4i-0000090000-f1af39007edb9d799840	2021-10-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 20V, Negative-QTOF	splash10-0a4i-0000390000-16c24486204f5dfa0c33	2021-10-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin 40V, Negative-QTOF	splash10-05i0-1351930000-f8e812ceaea62348fa83	2021-10-21	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB001643

KNApSAcK ID

Not Available

Chemspider ID

59696211

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

157009787

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Not Available

Showing metabocard for ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin (HMDB0301935)

MOL for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

3D MOL for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

3D SDF for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

3D-SDF for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

PDB for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

3D PDB for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

SMILES for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

INCHI for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

Structure for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

3D Structure for HMDB0301935 (ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Derivatized

MS/MS Spectra