| Name |
3-O-Galloylepicatechin-(4beta->6)-epicatechin-3-O-gallate |
| Formula |
C44H34O20 |
| Mw |
882.16434353 |
| CAS RN |
106533-60-2 |
| C_ID |
C00009207
, 
|
| InChIKey |
LFBGVECYPPCVDS-MXIYMYMONA-N |
| InChICode |
InChI=1S/C44H34O20/c45-19-11-25(50)34-32(12-19)62-41(16-2-4-22(47)24(49)6-16)42(64-44(60)18-9-29(54)39(58)30(55)10-18)36(34)35-26(51)14-31-20(37(35)56)13-33(40(61-31)15-1-3-21(46)23(48)5-15)63-43(59)17-7-27(52)38(57)28(53)8-17/h1-12,14,33,36,40-42,45-58H,13H2/t33-,36+,40-,41+,42+/m0/s1 |
| SMILES |
O=C(O[C@@H]1[C@@H](c2c(O)cc3c(c2O)C[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](c2ccc(O)c(O)c2)O3)c2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Polygonaceae | Rheum sp. | Ref. |
| Plantae | Polygonaceae | Rheum spp. | Ref. |
| Plantae | Theaceae | Camellia sinensis  | Ref. |
|
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