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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 17:52:33 UTC

Update Date

2022-03-07 02:53:30 UTC

HMDB ID

HMDB0032900

Secondary Accession Numbers

HMDB32900

Metabolite Identification

Common Name

Epicatechin-(6'->8)-epicatechin

Description

Epicatechin-(6'->8)-epicatechin belongs to the class of organic compounds known as catechins. Catechins are compounds containing a catechin moiety, which is a 3,4-dihydro-2-chromene-3,5.7-tiol. Epicatechin-(6'->8)-epicatechin has been detected, but not quantified in, alcoholic beverages and fruits. This could make epicatechin-(6'->8)-epicatechin a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Epicatechin-(6'->8)-epicatechin.

Structure

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

  Mrv0541 05061306462D          

 42 47  0  0  0  0            999 V2000
   -3.6304   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9159   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9159    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2014    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4869    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6369    0.1128    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5144    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2288    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9433    0.6844    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580    2.7469    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7999    1.9219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5930    0.7707    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725    1.5094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580    1.9219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565    1.5094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3709    1.9219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0854    1.5094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0854    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7999    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7999   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5144   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2288   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9433   -0.9656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3709    0.2719    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565   -1.7906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3709   -2.2031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6304    1.5094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6304    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3448    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3448   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0593   -0.9656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2014   -0.9656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4869   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725   -1.7906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580   -2.2031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580   -3.0281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 35  2  0  0  0  0
  2  3  2  0  0  0  0
  2 37  1  0  0  0  0
  3  4  1  0  0  0  0
  3 33  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 38  1  0  0  0  0
  7  8  2  0  0  0  0
  7 20  1  0  0  0  0
  8  9  1  0  0  0  0
  8 23  1  0  0  0  0
 10 15  1  0  0  0  0
 11 18  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 27  2  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 26  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 25  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 39  2  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 30 41  1  0  0  0  0
 32 33  1  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
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 41  2  0  0  0  0
 41 42  1  0  0  0  0
M  END

HMDB0032900
     RDKit          3D
Epicatechin-(6'->8)-epicatechin
 68 73  0  0  0  0  0  0  0  0999 V2000
    1.2248    4.3332   -1.7069 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9460    3.3051   -1.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3134    3.3031   -1.3028 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0815    2.3109   -0.7455 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4510    2.3046   -0.9222 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4585    1.3120    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1133    1.2961    0.1916 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3461    2.3010   -0.3733 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5276    0.2840    0.9434 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1762   -1.0050    1.0413 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8754   -1.8128   -0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7436   -1.9409   -1.1974 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3381   -2.7199   -2.3008 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2400   -2.8301   -3.3461 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1109   -3.3423   -2.3449 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7125   -4.1005   -3.4158 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2649   -3.1884   -1.2679 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6215   -2.4330   -0.1629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2389   -2.2754    0.9786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1430   -3.1445    2.0764 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8350   -4.1181    2.0444 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9822   -3.0550    3.1648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9715   -2.0709    3.1965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8261   -1.9824    4.3085 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0755   -1.2244    2.1416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2080   -1.3238    1.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4874   -0.3639    0.0642 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8026   -0.0978   -0.3644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9933    1.2781   -0.8862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6940    1.4178   -2.0735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9256    2.6573   -2.6341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4533    3.7924   -2.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6516    5.0646   -2.5162 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7500    3.6521   -0.8141 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2586    4.7642   -0.1514 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5253    2.3919   -0.2626 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7864   -0.3430    0.7415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9175    0.4661    0.6251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1334   -0.1775    2.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6474   -0.8213    1.2268 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3506   -2.0068    0.8662 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3381    0.2935    0.5676 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880    5.1790   -1.1399 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8175    4.0857   -1.8895 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0983    1.6517   -0.5645 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3009    2.2858   -0.2216 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7028   -1.4459    1.9671 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7145   -1.4691   -1.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9656   -3.3868   -4.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1842   -4.5537   -3.4422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7165   -3.6615   -1.2568 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9161   -4.7483    2.8276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9141   -3.7227    4.0178 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7270   -2.6276    5.0818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0722   -0.8380   -1.1847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0721    0.5377   -2.5808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4843    2.7424   -3.5796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1607    5.1951   -3.3824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4177    5.6740   -0.5474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9720    2.3079    0.6601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1308   -1.4065    0.7021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7126   -0.1047    0.5539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7755    0.8264    2.3137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9548   -0.4480    2.8314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8491   -0.6841    2.3602 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8217   -2.3175    1.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9928    0.8128    1.3629 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1350   -0.0340   -0.1600 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  1  0
  4  6  2  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 13 15  2  0
 15 16  1  0
 15 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
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 31 32  2  0
 32 33  1  0
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 34 35  1  0
 34 36  2  0
 28 37  1  0
 37 38  1  0
 37 39  1  0
 10 40  1  0
 40 41  1  0
 40 42  1  0
  8  2  1  0
 18 11  1  0
 26 19  1  0
 36 29  1  0
 42  6  1  0
 39 25  1  0
  1 43  1  0
  3 44  1  0
  5 45  1  0
  8 46  1  0
 10 47  1  0
 12 48  1  0
 14 49  1  0
 16 50  1  0
 17 51  1  0
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 24 54  1  0
 28 55  1  0
 30 56  1  0
 31 57  1  0
 33 58  1  0
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 37 61  1  0
 38 62  1  0
 39 63  1  0
 39 64  1  0
 40 65  1  0
 41 66  1  0
 42 67  1  0
 42 68  1  0
M  END

  Mrv0541 05061306462D          

 42 47  0  0  0  0            999 V2000
   -3.6304   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9159   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9159    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2014    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4869    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6369    0.1128    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5144    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2288    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9433    0.6844    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580    2.7469    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7999    1.9219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5930    0.7707    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725    1.5094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580    1.9219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565    1.5094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3709    1.9219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0854    1.5094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0854    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7999    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7999   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5144   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2288   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9433   -0.9656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6565    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0580   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6565   -1.7906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3709   -2.2031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6304    1.5094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6304    0.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3448    0.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3448   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0593   -0.9656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2014   -0.9656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4869   -0.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725   -0.9656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725   -1.7906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580   -2.2031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580   -3.0281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 35  2  0  0  0  0
  2  3  2  0  0  0  0
  2 37  1  0  0  0  0
  3  4  1  0  0  0  0
  3 33  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 38  1  0  0  0  0
  7  8  2  0  0  0  0
  7 20  1  0  0  0  0
  8  9  1  0  0  0  0
  8 23  1  0  0  0  0
 10 15  1  0  0  0  0
 11 18  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 27  2  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 26  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 25  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 39  2  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 30 41  1  0  0  0  0
 32 33  1  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
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 41  2  0  0  0  0
 41 42  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0032900

> <DATABASE_NAME>
hmdb

> <SMILES>
OC1CC2=C(OC1C1=CC=C(O)C(O)=C1)C(=C(O)C=C2O)C1=C(C=C(O)C(O)=C1)C1OC2=C(CC1O)C(O)=CC(O)=C2

> <INCHI_IDENTIFIER>
InChI=1S/C30H26O12/c31-12-4-18(33)15-8-25(40)29(41-26(15)5-12)14-7-22(37)21(36)6-13(14)27-23(38)10-19(34)16-9-24(39)28(42-30(16)27)11-1-2-17(32)20(35)3-11/h1-7,10,24-25,28-29,31-40H,8-9H2

> <INCHI_KEY>
NFKUCWGVXFRSRX-UHFFFAOYSA-N

> <FORMULA>
C30H26O12

> <MOLECULAR_WEIGHT>
578.5202

> <EXACT_MASS>
578.142426296

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
56.68815850991797

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol

> <ALOGPS_LOGP>
2.13

> <JCHEM_LOGP>
3.2641935766666657

> <ALOGPS_LOGS>
-3.84

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.05312723797487

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.577255728351751

> <JCHEM_PKA_STRONGEST_BASIC>
-5.384617954285397

> <JCHEM_POLAR_SURFACE_AREA>
220.75999999999996

> <JCHEM_REFRACTIVITY>
147.07759999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
8.37e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0032900
     RDKit          3D
Epicatechin-(6'->8)-epicatechin
 68 73  0  0  0  0  0  0  0  0999 V2000
    1.2248    4.3332   -1.7069 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9460    3.3051   -1.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3134    3.3031   -1.3028 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0815    2.3109   -0.7455 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4510    2.3046   -0.9222 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4585    1.3120    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1133    1.2961    0.1916 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3461    2.3010   -0.3733 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5276    0.2840    0.9434 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1762   -1.0050    1.0413 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8754   -1.8128   -0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7436   -1.9409   -1.1974 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3381   -2.7199   -2.3008 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2400   -2.8301   -3.3461 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1109   -3.3423   -2.3449 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7125   -4.1005   -3.4158 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2649   -3.1884   -1.2679 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6215   -2.4330   -0.1629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2389   -2.2754    0.9786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1430   -3.1445    2.0764 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8350   -4.1181    2.0444 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9822   -3.0550    3.1648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9715   -2.0709    3.1965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8261   -1.9824    4.3085 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0755   -1.2244    2.1416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2080   -1.3238    1.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4874   -0.3639    0.0642 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8026   -0.0978   -0.3644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9933    1.2781   -0.8862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6940    1.4178   -2.0735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9256    2.6573   -2.6341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4533    3.7924   -2.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6516    5.0646   -2.5162 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7500    3.6521   -0.8141 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2586    4.7642   -0.1514 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5253    2.3919   -0.2626 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7864   -0.3430    0.7415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9175    0.4661    0.6251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1334   -0.1775    2.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6474   -0.8213    1.2268 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3506   -2.0068    0.8662 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3381    0.2935    0.5676 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880    5.1790   -1.1399 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8175    4.0857   -1.8895 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0983    1.6517   -0.5645 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3009    2.2858   -0.2216 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7028   -1.4459    1.9671 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7145   -1.4691   -1.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9656   -3.3868   -4.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1842   -4.5537   -3.4422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7165   -3.6615   -1.2568 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9161   -4.7483    2.8276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9141   -3.7227    4.0178 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7270   -2.6276    5.0818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0722   -0.8380   -1.1847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0721    0.5377   -2.5808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4843    2.7424   -3.5796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1607    5.1951   -3.3824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4177    5.6740   -0.5474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9720    2.3079    0.6601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1308   -1.4065    0.7021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7126   -0.1047    0.5539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7755    0.8264    2.3137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9548   -0.4480    2.8314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8491   -0.6841    2.3602 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8217   -2.3175    1.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9928    0.8128    1.3629 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1350   -0.0340   -0.1600 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  1  0
  4  6  2  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 13 15  2  0
 15 16  1  0
 15 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
 23 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 31 32  2  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  2  0
 28 37  1  0
 37 38  1  0
 37 39  1  0
 10 40  1  0
 40 41  1  0
 40 42  1  0
  8  2  1  0
 18 11  1  0
 26 19  1  0
 36 29  1  0
 42  6  1  0
 39 25  1  0
  1 43  1  0
  3 44  1  0
  5 45  1  0
  8 46  1  0
 10 47  1  0
 12 48  1  0
 14 49  1  0
 16 50  1  0
 17 51  1  0
 21 52  1  0
 22 53  1  0
 24 54  1  0
 28 55  1  0
 30 56  1  0
 31 57  1  0
 33 58  1  0
 35 59  1  0
 36 60  1  0
 37 61  1  0
 38 62  1  0
 39 63  1  0
 39 64  1  0
 40 65  1  0
 41 66  1  0
 42 67  1  0
 42 68  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0      -6.777  -1.802   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -5.443  -1.032   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -5.443   0.508   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -4.109   1.278   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -2.776   0.508   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      -1.189   0.211   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       6.560   1.278   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       7.894   0.508   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       9.227   1.278   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0      -0.108   5.128   0.000  0.00  0.00           O+0
HETATM   11  O   UNK     0       5.226   3.588   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0      -2.974   1.439   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      -1.442   1.278   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -1.442   2.818   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.108   3.588   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.225   2.818   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       2.559   3.588   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       3.893   2.818   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       3.893   1.278   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       5.226   0.508   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       5.226  -1.032   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       6.560  -1.802   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       7.894  -1.032   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0       9.227  -1.802   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       2.559   0.508   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0       1.225   1.278   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -0.108   0.508   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -0.108  -1.032   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       1.225  -1.802   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       1.225  -3.342   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       2.559  -4.112   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0      -6.777   2.818   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0      -6.777   1.278   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      -8.110   0.508   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      -8.110  -1.032   0.000  0.00  0.00           C+0
HETATM   36  O   UNK     0      -9.444  -1.802   0.000  0.00  0.00           O+0
HETATM   37  O   UNK     0      -4.109  -1.802   0.000  0.00  0.00           O+0
HETATM   38  C   UNK     0      -2.776  -1.032   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      -1.442  -1.802   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      -1.442  -3.342   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0      -0.108  -4.112   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0      -0.108  -5.652   0.000  0.00  0.00           O+0
CONECT    1    2   35                                                       
CONECT    2    1    3   37                                                  
CONECT    3    2    4   33                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6   38                                                  
CONECT    6    5                                                            
CONECT    7    8   20                                                       
CONECT    8    7    9   23                                                  
CONECT    9    8                                                            
CONECT   10   15                                                            
CONECT   11   18                                                            
CONECT   12   13                                                            
CONECT   13   12   14   27                                                  
CONECT   14   13   15                                                       
CONECT   15   10   14   16                                                  
CONECT   16   15   17   26                                                  
CONECT   17   16   18                                                       
CONECT   18   11   17   19                                                  
CONECT   19   18   20   25                                                  
CONECT   20    7   19   21                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23    8   22   24                                                  
CONECT   24   23                                                            
CONECT   25   19   26                                                       
CONECT   26   16   25   27                                                  
CONECT   27   13   26   28                                                  
CONECT   28   27   29   39                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31   41                                                  
CONECT   31   30                                                            
CONECT   32   33                                                            
CONECT   33    3   32   34                                                  
CONECT   34   33   35                                                       
CONECT   35    1   34   36                                                  
CONECT   36   35                                                            
CONECT   37    2   38                                                       
CONECT   38    5   37   39                                                  
CONECT   39   28   38   40                                                  
CONECT   40   39   41                                                       
CONECT   41   30   40   42                                                  
CONECT   42   41                                                            
MASTER        0    0    0    0    0    0    0    0   42    0   94    0
END

COMPND    HMDB0032900
HETATM    1  O1  UNL     1       1.225   4.333  -1.707  1.00  0.00           O  
HETATM    2  C1  UNL     1       1.946   3.305  -1.121  1.00  0.00           C  
HETATM    3  C2  UNL     1       3.313   3.303  -1.303  1.00  0.00           C  
HETATM    4  C3  UNL     1       4.082   2.311  -0.746  1.00  0.00           C  
HETATM    5  O2  UNL     1       5.451   2.305  -0.922  1.00  0.00           O  
HETATM    6  C4  UNL     1       3.458   1.312   0.001  1.00  0.00           C  
HETATM    7  C5  UNL     1       2.113   1.296   0.192  1.00  0.00           C  
HETATM    8  C6  UNL     1       1.346   2.301  -0.373  1.00  0.00           C  
HETATM    9  O3  UNL     1       1.528   0.284   0.943  1.00  0.00           O  
HETATM   10  C7  UNL     1       2.176  -1.005   1.041  1.00  0.00           C  
HETATM   11  C8  UNL     1       1.875  -1.813  -0.148  1.00  0.00           C  
HETATM   12  C9  UNL     1       2.744  -1.941  -1.197  1.00  0.00           C  
HETATM   13  C10 UNL     1       2.338  -2.720  -2.301  1.00  0.00           C  
HETATM   14  O4  UNL     1       3.240  -2.830  -3.346  1.00  0.00           O  
HETATM   15  C11 UNL     1       1.111  -3.342  -2.345  1.00  0.00           C  
HETATM   16  O5  UNL     1       0.712  -4.101  -3.416  1.00  0.00           O  
HETATM   17  C12 UNL     1       0.265  -3.188  -1.268  1.00  0.00           C  
HETATM   18  C13 UNL     1       0.622  -2.433  -0.163  1.00  0.00           C  
HETATM   19  C14 UNL     1      -0.239  -2.275   0.979  1.00  0.00           C  
HETATM   20  C15 UNL     1      -0.143  -3.145   2.076  1.00  0.00           C  
HETATM   21  O6  UNL     1       0.835  -4.118   2.044  1.00  0.00           O  
HETATM   22  C16 UNL     1      -0.982  -3.055   3.165  1.00  0.00           C  
HETATM   23  C17 UNL     1      -1.972  -2.071   3.197  1.00  0.00           C  
HETATM   24  O7  UNL     1      -2.826  -1.982   4.308  1.00  0.00           O  
HETATM   25  C18 UNL     1      -2.076  -1.224   2.142  1.00  0.00           C  
HETATM   26  C19 UNL     1      -1.208  -1.324   1.029  1.00  0.00           C  
HETATM   27  O8  UNL     1      -1.487  -0.364   0.064  1.00  0.00           O  
HETATM   28  C20 UNL     1      -2.803  -0.098  -0.364  1.00  0.00           C  
HETATM   29  C21 UNL     1      -2.993   1.278  -0.886  1.00  0.00           C  
HETATM   30  C22 UNL     1      -3.694   1.418  -2.074  1.00  0.00           C  
HETATM   31  C23 UNL     1      -3.926   2.657  -2.634  1.00  0.00           C  
HETATM   32  C24 UNL     1      -3.453   3.792  -2.006  1.00  0.00           C  
HETATM   33  O9  UNL     1      -3.652   5.065  -2.516  1.00  0.00           O  
HETATM   34  C25 UNL     1      -2.750   3.652  -0.814  1.00  0.00           C  
HETATM   35  O10 UNL     1      -2.259   4.764  -0.151  1.00  0.00           O  
HETATM   36  C26 UNL     1      -2.525   2.392  -0.263  1.00  0.00           C  
HETATM   37  C27 UNL     1      -3.786  -0.343   0.742  1.00  0.00           C  
HETATM   38  O11 UNL     1      -4.917   0.466   0.625  1.00  0.00           O  
HETATM   39  C28 UNL     1      -3.133  -0.178   2.105  1.00  0.00           C  
HETATM   40  C29 UNL     1       3.647  -0.821   1.227  1.00  0.00           C  
HETATM   41  O12 UNL     1       4.351  -2.007   0.866  1.00  0.00           O  
HETATM   42  C30 UNL     1       4.338   0.293   0.568  1.00  0.00           C  
HETATM   43  H1  UNL     1       1.088   5.179  -1.140  1.00  0.00           H  
HETATM   44  H2  UNL     1       3.817   4.086  -1.889  1.00  0.00           H  
HETATM   45  H3  UNL     1       6.098   1.652  -0.565  1.00  0.00           H  
HETATM   46  H4  UNL     1       0.301   2.286  -0.222  1.00  0.00           H  
HETATM   47  H5  UNL     1       1.703  -1.446   1.967  1.00  0.00           H  
HETATM   48  H6  UNL     1       3.714  -1.469  -1.226  1.00  0.00           H  
HETATM   49  H7  UNL     1       2.966  -3.387  -4.145  1.00  0.00           H  
HETATM   50  H8  UNL     1      -0.184  -4.554  -3.442  1.00  0.00           H  
HETATM   51  H9  UNL     1      -0.716  -3.662  -1.257  1.00  0.00           H  
HETATM   52  H10 UNL     1       0.916  -4.748   2.828  1.00  0.00           H  
HETATM   53  H11 UNL     1      -0.914  -3.723   4.018  1.00  0.00           H  
HETATM   54  H12 UNL     1      -2.727  -2.628   5.082  1.00  0.00           H  
HETATM   55  H13 UNL     1      -3.072  -0.838  -1.185  1.00  0.00           H  
HETATM   56  H14 UNL     1      -4.072   0.538  -2.581  1.00  0.00           H  
HETATM   57  H15 UNL     1      -4.484   2.742  -3.580  1.00  0.00           H  
HETATM   58  H16 UNL     1      -4.161   5.195  -3.382  1.00  0.00           H  
HETATM   59  H17 UNL     1      -2.418   5.674  -0.547  1.00  0.00           H  
HETATM   60  H18 UNL     1      -1.972   2.308   0.660  1.00  0.00           H  
HETATM   61  H19 UNL     1      -4.131  -1.406   0.702  1.00  0.00           H  
HETATM   62  H20 UNL     1      -5.713  -0.105   0.554  1.00  0.00           H  
HETATM   63  H21 UNL     1      -2.775   0.826   2.314  1.00  0.00           H  
HETATM   64  H22 UNL     1      -3.955  -0.448   2.831  1.00  0.00           H  
HETATM   65  H23 UNL     1       3.849  -0.684   2.360  1.00  0.00           H  
HETATM   66  H24 UNL     1       4.822  -2.318   1.648  1.00  0.00           H  
HETATM   67  H25 UNL     1       4.993   0.813   1.363  1.00  0.00           H  
HETATM   68  H26 UNL     1       5.135  -0.034  -0.160  1.00  0.00           H  
CONECT    1    2   43
CONECT    2    3    3    8
CONECT    3    4   44
CONECT    4    5    6    6
CONECT    5   45
CONECT    6    7   42
CONECT    7    8    8    9
CONECT    8   46
CONECT    9   10
CONECT   10   11   40   47
CONECT   11   12   12   18
CONECT   12   13   48
CONECT   13   14   15   15
CONECT   14   49
CONECT   15   16   17
CONECT   16   50
CONECT   17   18   18   51
CONECT   18   19
CONECT   19   20   20   26
CONECT   20   21   22
CONECT   21   52
CONECT   22   23   23   53
CONECT   23   24   25
CONECT   24   54
CONECT   25   26   26   39
CONECT   26   27
CONECT   27   28
CONECT   28   29   37   55
CONECT   29   30   30   36
CONECT   30   31   56
CONECT   31   32   32   57
CONECT   32   33   34
CONECT   33   58
CONECT   34   35   36   36
CONECT   35   59
CONECT   36   60
CONECT   37   38   39   61
CONECT   38   62
CONECT   39   63   64
CONECT   40   41   42   65
CONECT   41   66
CONECT   42   67   68
END

HMDB0032900
     RDKit          3D
Epicatechin-(6'->8)-epicatechin
 68 73  0  0  0  0  0  0  0  0999 V2000
    1.2248    4.3332   -1.7069 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9460    3.3051   -1.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3134    3.3031   -1.3028 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0815    2.3109   -0.7455 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4510    2.3046   -0.9222 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4585    1.3120    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1133    1.2961    0.1916 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3461    2.3010   -0.3733 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5276    0.2840    0.9434 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1762   -1.0050    1.0413 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8754   -1.8128   -0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7436   -1.9409   -1.1974 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3381   -2.7199   -2.3008 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2400   -2.8301   -3.3461 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1109   -3.3423   -2.3449 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7125   -4.1005   -3.4158 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2649   -3.1884   -1.2679 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6215   -2.4330   -0.1629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2389   -2.2754    0.9786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1430   -3.1445    2.0764 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8350   -4.1181    2.0444 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9822   -3.0550    3.1648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9715   -2.0709    3.1965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8261   -1.9824    4.3085 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0755   -1.2244    2.1416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2080   -1.3238    1.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4874   -0.3639    0.0642 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8026   -0.0978   -0.3644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9933    1.2781   -0.8862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6940    1.4178   -2.0735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9256    2.6573   -2.6341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4533    3.7924   -2.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6516    5.0646   -2.5162 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7500    3.6521   -0.8141 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2586    4.7642   -0.1514 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5253    2.3919   -0.2626 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7864   -0.3430    0.7415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9175    0.4661    0.6251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1334   -0.1775    2.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6474   -0.8213    1.2268 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3506   -2.0068    0.8662 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3381    0.2935    0.5676 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880    5.1790   -1.1399 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8175    4.0857   -1.8895 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0983    1.6517   -0.5645 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3009    2.2858   -0.2216 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7028   -1.4459    1.9671 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7145   -1.4691   -1.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9656   -3.3868   -4.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1842   -4.5537   -3.4422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7165   -3.6615   -1.2568 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9161   -4.7483    2.8276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9141   -3.7227    4.0178 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7270   -2.6276    5.0818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0722   -0.8380   -1.1847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0721    0.5377   -2.5808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4843    2.7424   -3.5796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1607    5.1951   -3.3824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4177    5.6740   -0.5474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9720    2.3079    0.6601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1308   -1.4065    0.7021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7126   -0.1047    0.5539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7755    0.8264    2.3137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9548   -0.4480    2.8314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8491   -0.6841    2.3602 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8217   -2.3175    1.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9928    0.8128    1.3629 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1350   -0.0340   -0.1600 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  1  0
  4  6  2  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 13 15  2  0
 15 16  1  0
 15 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
 23 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 31 32  2  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  2  0
 28 37  1  0
 37 38  1  0
 37 39  1  0
 10 40  1  0
 40 41  1  0
 40 42  1  0
  8  2  1  0
 18 11  1  0
 26 19  1  0
 36 29  1  0
 42  6  1  0
 39 25  1  0
  1 43  1  0
  3 44  1  0
  5 45  1  0
  8 46  1  0
 10 47  1  0
 12 48  1  0
 14 49  1  0
 16 50  1  0
 17 51  1  0
 21 52  1  0
 22 53  1  0
 24 54  1  0
 28 55  1  0
 30 56  1  0
 31 57  1  0
 33 58  1  0
 35 59  1  0
 36 60  1  0
 37 61  1  0
 38 62  1  0
 39 63  1  0
 39 64  1  0
 40 65  1  0
 41 66  1  0
 42 67  1  0
 42 68  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Value	Source
Epicatechin(6'->8)epicatechin	HMDB

Chemical Formula

C₃₀H₂₆O₁₂

Average Molecular Weight

578.5202

Monoisotopic Molecular Weight

578.142426296

IUPAC Name

8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol

Traditional Name

8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol

CAS Registry Number

Not Available

SMILES

OC1CC2=C(OC1C1=CC=C(O)C(O)=C1)C(=C(O)C=C2O)C1=C(C=C(O)C(O)=C1)C1OC2=C(CC1O)C(O)=CC(O)=C2

InChI Identifier

InChI=1S/C30H26O12/c31-12-4-18(33)15-8-25(40)29(41-26(15)5-12)14-7-22(37)21(36)6-13(14)27-23(38)10-19(34)16-9-24(39)28(42-30(16)27)11-1-2-17(32)20(35)3-11/h1-7,10,24-25,28-29,31-40H,8-9H2

InChI Key

NFKUCWGVXFRSRX-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as catechins. Catechins are compounds containing a catechin moiety, which is a 3,4-dihydro-2-chromene-3,5.7-Tiol.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavans

Direct Parent

Catechins

Alternative Parents

Substituents

Catechin
Hydroxyflavonoid
7-hydroxyflavonoid
5-hydroxyflavonoid
4'-hydroxyflavonoid
3-hydroxyflavonoid
3'-hydroxyflavonoid
Biphenol
1-benzopyran
Benzopyran
Chromane
Catechol
Phenol
Alkyl aryl ether
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Benzenoid
Monocyclic benzene moiety
Secondary alcohol
Oxacycle
Organoheterocyclic compound
Polyol
Ether
Organic oxygen compound
Alcohol
Organooxygen compound
Hydrocarbon derivative
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Exogenous (HMDB: HMDB32900)

Food

Fruit

Fruits (FooDB: FOOD00871)

Beverage

Alcoholic beverage

Alcoholic beverages (FooDB: FOOD00854)

Process

Not Available

Role

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	0.084 g/L	ALOGPS
logP	2.13	ALOGPS
logP	3.26	ChemAxon
logS	-3.8	ALOGPS
pKa (Strongest Acidic)	8.58	ChemAxon
pKa (Strongest Basic)	-5.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	10	ChemAxon
Polar Surface Area	220.76 Å²	ChemAxon
Rotatable Bond Count	2	ChemAxon
Refractivity	147.08 m³·mol⁻¹	ChemAxon
Polarizability	56.69 Å³	ChemAxon
Number of Rings	6	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]+	230.058	31661259
DarkChem	[M-H]-	221.76	31661259
DeepCCS	[M+H]+	221.466	30932474
DeepCCS	[M-H]-	219.583	30932474
DeepCCS	[M-2H]-	252.824	30932474
DeepCCS	[M+Na]+	227.072	30932474
AllCCS	[M+H]+	238.7	32859911
AllCCS	[M+H-H2O]+	237.0	32859911
AllCCS	[M+NH4]+	240.2	32859911
AllCCS	[M+Na]+	240.6	32859911
AllCCS	[M-H]-	233.6	32859911
AllCCS	[M+Na-2H]-	235.4	32859911
AllCCS	[M+HCOO]-	237.6	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Epicatechin-(6'->8)-epicatechin	OC1CC2=C(OC1C1=CC=C(O)C(O)=C1)C(=C(O)C=C2O)C1=C(C=C(O)C(O)=C1)C1OC2=C(CC1O)C(O)=CC(O)=C2	7171.8	Standard polar	33892256
Epicatechin-(6'->8)-epicatechin	OC1CC2=C(OC1C1=CC=C(O)C(O)=C1)C(=C(O)C=C2O)C1=C(C=C(O)C(O)=C1)C1OC2=C(CC1O)C(O)=CC(O)=C2	4702.0	Standard non polar	33892256
Epicatechin-(6'->8)-epicatechin	OC1CC2=C(OC1C1=CC=C(O)C(O)=C1)C(=C(O)C=C2O)C1=C(C=C(O)C(O)=C1)C1OC2=C(CC1O)C(O)=CC(O)=C2	6058.6	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #1	C[Si](C)(C)OC1CC2=C(O)C=C(O)C(C3=CC(O)=C(O)C=C3C3OC4=CC(O)=CC(O)=C4CC3O)=C2OC1C1=CC=C(O)C(O)=C1	5675.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5694.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #2	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5713.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #3	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5691.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #4	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC=C(O)C(O)=C3)OC2=C1C1=CC(O)=C(O)C=C1C1OC2=CC(O)=CC(O)=C2CC1O	5722.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #5	C[Si](C)(C)OC1=CC(O)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C2=C1CC(O)C(C1=CC=C(O)C(O)=C1)O2	5704.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #6	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5698.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #7	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5718.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #8	C[Si](C)(C)OC1CC2=C(O)C=C(O)C=C2OC1C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C2=C1OC(C1=CC=C(O)C(O)=C1)C(O)C2	5698.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TMS,isomer #9	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5680.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #1	C[Si](C)(C)OC1=CC(O)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C2=C1CC(O[Si](C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	5570.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #10	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5582.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #11	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5598.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #12	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5586.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #13	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5566.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5581.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #15	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5565.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #16	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5596.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #17	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5559.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #18	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5554.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #19	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5567.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC=C(O)C(O)=C3)OC2=C1C1=CC(O)=C(O)C=C1C1OC2=CC(O)=CC(O)=C2CC1O	5587.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #20	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5553.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #21	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5531.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #22	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5545.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #23	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5538.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #24	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5568.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #25	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C2=C1CC(O)C(C1=CC=C(O)C(O)=C1)O2	5577.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #26	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5588.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #27	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5567.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #28	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5587.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #29	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5577.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #3	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5567.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC=C(O)C(O)=C3)OC2=C1C1=CC(O)=C(O)C=C1C1OC2=CC(O)=CC(O)=C2CC1O[Si](C)(C)C	5607.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #31	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5570.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #32	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5553.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #33	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5566.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #34	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O[Si](C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5556.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C2=C1CC(O)C(C1=CC=C(O)C(O)=C1)O2	5582.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #36	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5550.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #37	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5539.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #38	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5570.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #39	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5561.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #4	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5556.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5568.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #41	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5554.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #42	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5584.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #43	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5573.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #44	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5581.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #45	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5550.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #5	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5556.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #6	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C)C3)O2	5543.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #7	C[Si](C)(C)OC1CC2=C(O)C=C(O)C(C3=CC(O)=C(O)C=C3C3OC4=CC(O)=CC(O)=C4CC3O[Si](C)(C)C)=C2OC1C1=CC=C(O)C(O)=C1	5574.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #8	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5579.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TMS,isomer #9	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5555.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #1	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C2=C1CC(O[Si](C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	5453.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #10	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5446.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #100	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5465.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #101	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5427.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #102	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5436.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #103	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5464.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #104	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5470.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #105	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5415.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #106	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5427.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #107	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5455.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #108	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5435.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #109	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5459.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #11	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5448.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #110	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O[Si](C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5453.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #111	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5407.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #112	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5451.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #113	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5435.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #114	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5439.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #115	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5452.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #116	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5477.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #117	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5419.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #118	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5447.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #119	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5451.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C)C3)O2	5443.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #120	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5452.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #13	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC=C(O)C(O)=C3)OC2=C1C1=CC(O)=C(O)C=C1C1OC2=CC(O)=CC(O)=C2CC1O[Si](C)(C)C	5487.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #14	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5475.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #15	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5455.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #16	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5466.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #17	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5438.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5438.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #19	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5434.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #2	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5453.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #20	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5465.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #21	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5463.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #22	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5425.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #23	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5421.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #24	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5458.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #25	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5447.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #26	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5421.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #27	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5436.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #28	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5455.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #29	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5430.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #3	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5441.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5470.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #31	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C)C3)O2	5464.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #32	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5446.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #33	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5427.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #34	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5480.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #35	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5461.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #36	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5468.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #37	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5461.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #38	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5433.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #39	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5420.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #4	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5443.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5431.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #41	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5442.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #42	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5482.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #43	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5476.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #44	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5436.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #45	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5420.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #46	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5440.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #47	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5451.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #48	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5491.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #49	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5486.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #5	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O[Si](C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C)C3)O2	5436.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #50	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5478.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #51	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5401.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #52	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5413.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #53	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5468.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #54	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5469.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #55	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5384.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #56	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5400.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #57	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5452.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #58	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)C=C1O	5452.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #59	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5424.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #6	C[Si](C)(C)OC1=CC(O)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C2=C1CC(O[Si](C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	5479.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5461.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #61	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5464.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #62	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5465.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #63	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5458.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #64	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5477.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #65	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5432.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #66	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5403.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #67	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5389.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #68	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5403.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #69	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5418.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #7	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5469.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #70	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5452.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #71	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5404.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #72	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5385.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #73	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5408.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #74	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5423.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #75	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5461.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #76	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5441.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #77	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5369.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #78	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5386.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #79	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5434.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #8	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5447.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #80	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5351.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #81	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5371.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #82	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5418.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #83	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5398.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #84	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5430.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #85	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=CC=C1O	5439.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #86	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5448.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #87	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5436.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #88	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5437.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #89	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5441.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #9	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5460.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #90	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C2=C1CC(O)C(C1=CC=C(O)C(O)=C1)O2	5470.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #91	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5427.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #92	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5438.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #93	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5472.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #94	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5474.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #95	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5413.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #96	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5426.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #97	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5460.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #98	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5442.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,3TMS,isomer #99	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5470.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #1	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5333.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5316.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #100	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5287.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #101	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5343.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #102	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5328.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #103	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5339.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #104	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5347.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #105	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5394.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #106	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5323.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #107	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5220.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #108	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5237.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #109	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5300.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #11	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5319.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #110	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5328.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #111	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5211.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #112	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5228.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #113	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5295.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #114	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)C=C1O	5315.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #115	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5277.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #116	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5346.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #117	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5327.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #118	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5339.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #119	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5352.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #12	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5355.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #120	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5396.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #121	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5287.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #122	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5304.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #123	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5374.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #124	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5381.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #125	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5229.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #126	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5295.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #127	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5269.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #128	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5288.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #129	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5303.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #13	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5374.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #130	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5371.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #131	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5220.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #132	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5283.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #133	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5263.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #134	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5279.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #135	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)C=C1O	5292.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #136	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)C=C1O	5357.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #137	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5324.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #138	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5344.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #139	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5377.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5308.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #140	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5377.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #141	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5230.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #142	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5219.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #143	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5260.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #144	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5275.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #145	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5327.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #146	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5297.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #147	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5217.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #148	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5236.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #149	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5279.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #15	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5312.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #150	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5208.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #151	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5222.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #152	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5272.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #153	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5272.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #154	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5309.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #155	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=CC=C1O	5319.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #156	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5295.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #157	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5208.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #158	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5222.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #159	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5276.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #16	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5347.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #160	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5199.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #161	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5211.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #162	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5268.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #163	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5262.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #164	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5306.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #165	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=CC=C1O	5317.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #166	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5265.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #167	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5281.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #168	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5344.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #169	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5217.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #17	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5295.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #170	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5253.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #171	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=CC=C1O	5267.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #172	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5207.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #173	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)OC2=C1	5247.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #174	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=CC=C1O	5258.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #175	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5304.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #176	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5273.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #177	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5286.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #178	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5337.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #179	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5348.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #18	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5280.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #180	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5265.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #181	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5276.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #182	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5332.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #183	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5317.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #184	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5350.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #185	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5345.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #186	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5277.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #187	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5328.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #188	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5319.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #189	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5324.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #19	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5342.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #190	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5335.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #191	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5379.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #192	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5267.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #193	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5313.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #194	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5318.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #195	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5351.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #196	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5285.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #197	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5335.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #198	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5323.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #199	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5329.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #2	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5323.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5323.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #200	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5342.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #201	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5382.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #202	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5276.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #203	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5318.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #204	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5323.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #205	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5353.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #206	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5313.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #207	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5335.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #208	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5368.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #209	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5363.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5309.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #210	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C)=C1	5319.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #22	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5360.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #23	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O[Si](C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C)C3)O2	5353.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #24	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5329.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #25	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5319.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #26	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5374.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #27	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5360.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #28	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5393.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #29	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5303.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5332.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #30	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5284.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #31	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5313.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #32	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5316.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #33	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5354.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #34	C[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5373.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5302.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #36	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5306.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #37	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=C(C2=C(O[Si](C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5346.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #38	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5290.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #39	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5269.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #4	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C)C3)O2	5331.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #40	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5339.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #41	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5324.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #42	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5306.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #43	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5357.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #44	C[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C)C3)O2	5356.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #45	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5328.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #46	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5314.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #47	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5372.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #48	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5358.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #49	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5396.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #5	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C2=C1CC(O[Si](C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	5366.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #50	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5376.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #51	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5270.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #52	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5280.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #53	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5354.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #54	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5382.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #55	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5355.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #56	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5255.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #57	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5267.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #58	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5333.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #59	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5313.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #6	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5346.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5355.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #61	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5343.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #62	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5336.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #63	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5356.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #64	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5393.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #65	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5305.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #66	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5257.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #67	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5242.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #68	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5334.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #69	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C)C3)C=C1O	5325.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #7	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5332.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #70	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5270.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #71	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)=CC=C1O	5254.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #72	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5340.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #73	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)=CC=C1O	5319.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #74	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C3)C=C1O	5367.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #75	C[Si](C)(C)OC1=CC2=C(CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5352.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #76	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5319.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #77	C[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)O2)C(O[Si](C)(C)C)=C1	5303.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #78	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5375.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #79	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5357.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #8	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5308.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #80	C[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C)=C3)C(O[Si](C)(C)C)C4)OC2=C1	5342.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #81	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)C=C1O	5353.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #82	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O[Si](C)(C)C)=CC=C1O	5341.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #83	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O[Si](C)(C)C	5373.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #84	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O[Si](C)(C)C	5405.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #85	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5244.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #86	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5236.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #87	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5276.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #88	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5294.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #89	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5349.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #9	C[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5294.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #90	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C	5363.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #91	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5320.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #92	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5227.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #93	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5252.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #94	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O[Si](C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5302.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #95	C[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5322.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #96	C[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C(O)=C3)C(O)C4)OC2=C1	5220.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #97	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3CC2O)C=C1O	5239.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #98	C[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C)C=C1O	5295.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,4TMS,isomer #99	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O[Si](C)(C)C)C3=C2OC(C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C3)C=C1O	5311.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1CC2=C(O)C=C(O)C(C3=CC(O)=C(O)C=C3C3OC4=CC(O)=CC(O)=C4CC3O)=C2OC1C1=CC=C(O)C(O)=C1	5939.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	5915.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5946.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	5937.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC=C(O)C(O)=C3)OC2=C1C1=CC(O)=C(O)C=C1C1OC2=CC(O)=CC(O)=C2CC1O	5947.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(O)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C2=C1CC(O)C(C1=CC=C(O)C(O)=C1)O2	5924.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	5939.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	5955.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1CC2=C(O)C=C(O)C=C2OC1C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C2=C1OC(C1=CC=C(O)C(O)=C1)C(O)C2	5953.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	5911.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1=CC(O)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C2=C1CC(O[Si](C)(C)C(C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	6117.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6112.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6128.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6113.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6101.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C(O)C4)OC2=C1	6099.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3CC2O)C=C1O	6096.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C(C)(C)C)C=C1O	6141.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C(C)(C)C	6105.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	6096.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	6112.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O)=C3)OC2=C1C1=CC(O)=C(O)C=C1C1OC2=CC(O)=CC(O)=C2CC1O	6124.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	6094.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	6084.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C(O)C4)OC2=C1	6079.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3CC2O)=CC=C1O	6081.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C(C)(C)C)=CC=C1O	6127.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C2=C1CC(O)C(C1=CC=C(O)C(O)=C1)O2	6095.7	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[Si](C)(C)C(C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6122.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O[Si](C)(C)C(C)(C)C)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	6108.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	6103.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O[Si](C)(C)C(C)(C)C)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	6098.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6129.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC=C(O)C(O)=C3)OC2=C1C1=CC(O)=C(O)C=C1C1OC2=CC(O)=CC(O)=C2CC1O[Si](C)(C)C(C)(C)C	6142.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O)C=C(O[Si](C)(C)C(C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6106.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O[Si](C)(C)C(C)(C)C)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	6096.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	6084.8	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O[Si](C)(C)C(C)(C)C)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	6081.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(O)=C(C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C(C)(C)C)C2=C1CC(O)C(C1=CC=C(O)C(O)=C1)O2	6126.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O[Si](C)(C)C(C)(C)C)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	6084.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	6083.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C(C)(C)C)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)C=C1O	6131.9	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O[Si](C)(C)C(C)(C)C	6106.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3CC2O)=C(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C3)C=C1O	6123.6	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	6095.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3CC2O)C=C1O	6091.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O)C=C(O)C3=C2OC(C2=CC=C(O)C(O)=C2)C(O)C3)=C(C2OC3=CC(O)=CC(O)=C3CC2O[Si](C)(C)C(C)(C)C)C=C1O	6139.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1CC(O[Si](C)(C)C(C)(C)C)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O)C3)O2	6116.1	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O[Si](C)(C)C(C)(C)C)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)OC2=C1	6111.5	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O)C4)O2)C(O[Si](C)(C)C(C)(C)C)=C1	6068.4	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2CC(O)C(C3=CC(O)=C(O)C=C3C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C(O)=C3)C(O[Si](C)(C)C(C)(C)C)C4)OC2=C1	6094.2	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1CC(O)C(C1=CC(O)=C(O)C=C1C1=C(O)C=C(O)C3=C1OC(C1=CC=C(O)C(O)=C1)C(O[Si](C)(C)C(C)(C)C)C3)O2	6092.3	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1CC2=C(O)C=C(O)C(C3=CC(O)=C(O)C=C3C3OC4=CC(O)=CC(O)=C4CC3O[Si](C)(C)C(C)(C)C)=C2OC1C1=CC=C(O)C(O)=C1	6127.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=C(CC2O[Si](C)(C)C(C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)C=C1O	6132.0	Semi standard non polar	33892256
Epicatechin-(6'->8)-epicatechin,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=C(CC2O[Si](C)(C)C(C)(C)C)C(O)=CC(O)=C3C2=CC(O)=C(O)C=C2C2OC3=CC(O)=CC(O)=C3CC2O)=CC=C1O	6122.2	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 - Epicatechin-(6'->8)-epicatechin GC-MS (Non-derivatized) - 70eV, Positive	splash10-03di-0702490000-84167f25f9c775cac46d	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (1 TMS) - 70eV, Positive	splash10-009i-9300514000-97fdbe4cf8353863cac5	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS ("Epicatechin-(6'->8)-epicatechin,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_1_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Epicatechin-(6'->8)-epicatechin GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 10V, Positive-QTOF	splash10-004i-0600690000-10fa38969aca8fb4ed7a	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 20V, Positive-QTOF	splash10-000i-0900320000-8591324dba532a3f7ac7	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 40V, Positive-QTOF	splash10-00di-0931010000-7ed8ae146741d8ef81e6	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 10V, Negative-QTOF	splash10-004i-0200190000-c555814b4ea804ad2ef3	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 20V, Negative-QTOF	splash10-002r-0910430000-31695d7c4c3c743fa497	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 40V, Negative-QTOF	splash10-056r-0900000000-15f7cae46d05a2ba49f2	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 10V, Positive-QTOF	splash10-004i-0000090000-41c3f76637c5517a0963	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 20V, Positive-QTOF	splash10-004i-0100390000-2cd38cc7e4d5e7e895f6	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 40V, Positive-QTOF	splash10-0hbi-0912560000-940180895bd6c71bc968	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 10V, Negative-QTOF	splash10-004i-0000090000-a567f32628696ab5aae8	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 20V, Negative-QTOF	splash10-056r-0200190000-14ee544f650fc315f025	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Epicatechin-(6'->8)-epicatechin 40V, Negative-QTOF	splash10-05dj-0201960000-44a82c0932ca70305938	2021-09-24	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

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

FDB010882

KNApSAcK ID

Not Available

Chemspider ID

35013516

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

56941146

PDB ID

Not Available

ChEBI ID

173293

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

(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Enzymes

Enzyme Details

1. Catechol O-methyltransferase

General function:: Involved in magnesium ion binding
Specific function:: Catalyzes the O-methylation, and thereby the inactivation, of catecholamine neurotransmitters and catechol hormones. Also shortens the biological half-lives of certain neuroactive drugs, like L-DOPA, alpha-methyl DOPA and isoproterenol.
Gene Name:: COMT
Uniprot ID:: P21964
Molecular weight:: 30036.77

Reactions

Epicatechin-(6'->8)-epicatechin → 8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol	details

Enzyme Details

2. UDP-glucuronosyltransferase 1-1

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

Reactions

Epicatechin-(6'->8)-epicatechin → 6-[(2-{2-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-4,5-dihydroxyphenyl}-3,5-dihydroxy-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid	details
Epicatechin-(6'->8)-epicatechin → 6-{4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-2-hydroxy-5-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid	details
Epicatechin-(6'->8)-epicatechin → 6-({8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-1-benzopyran-7-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details
Epicatechin-(6'->8)-epicatechin → 6-(5-{8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl}-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details

Enzyme Details

3. Sulfotransferase 1A3

General function:: sulfotransferase activity
Specific function:: Sulfotransferase that utilizes 3'-phospho-5'-adenylyl sulfate (PAPS) as sulfonate donor to catalyze the sulfate conjugation of phenolic monoamines (neurotransmitters such as dopamine, norepinephrine and serotonin) and phenolic and catechol drugs.
Gene Name:: SULT1A3
Uniprot ID:: P0DMM9
Molecular weight:: 34195.96

Reactions

Epicatechin-(6'->8)-epicatechin → (5-{8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl}-2-hydroxyphenyl)oxidanesulfonic acid	details

Showing metabocard for Epicatechin-(6'->8)-epicatechin (HMDB0032900)

MOL for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

3D MOL for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

3D SDF for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

3D-SDF for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

PDB for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

3D PDB for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

SMILES for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

INCHI for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

Structure for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

3D Structure for HMDB0032900 (Epicatechin-(6'->8)-epicatechin)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

Enzymes

Reactions

Reactions

Reactions