| Name |
[Gallocatechin-(4alpha->8)]2-catechin |
| Formula |
C45H38O20 |
| Mw |
898.19564366 |
| CAS RN |
79136-97-3 |
| C_ID |
C00009120
, 
|
| InChIKey |
RJFFPCHJOFXZQD-JFKZPVBINA-N |
| InChICode |
InChI=1S/C45H38O20/c46-16-8-21(50)31-30(9-16)63-42(14-4-25(54)37(59)26(55)5-14)39(61)35(31)33-23(52)12-24(53)34-36(40(62)43(65-45(33)34)15-6-27(56)38(60)28(57)7-15)32-22(51)11-19(48)17-10-29(58)41(64-44(17)32)13-1-2-18(47)20(49)3-13/h1-9,11-12,29,35-36,39-43,46-62H,10H2/t29-,35-,36-,39-,40-,41-,42+,43+/m0/s1 |
| SMILES |
c12c([C@H]([C@@H]([C@H](O1)c1cc(c(c(c1)O)O)O)O)c1c3c([C@@H]([C@@H]([C@H](O3)c3cc(c(c(c3)O)O)O)O)c3c4c(C[C@@H]([C@@H](O4)c4ccc(c(c4)O)O)O)c(cc3O)O)c(cc1O)O)c(cc(c2)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cistaceae | Cistus incanus | Ref. |
| Plantae | Poaceae | Hordeum vulgare  | Ref. |
|
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