| Name |
[Gallocatechin-(4alpha->8)]2-gallocatechin |
| Formula |
C45H38O21 |
| Mw |
914.19055828 |
| CAS RN |
87402-90-2 |
| C_ID |
C00009121
, 
|
| InChIKey |
NVTLDVSBUJGIAD-NMLPFRRHNA-N |
| InChICode |
InChI=1S/C45H38O21/c46-15-7-18(48)30-29(8-15)64-42(13-3-24(54)37(60)25(55)4-13)39(62)34(30)32-20(50)11-21(51)33-35(40(63)43(66-45(32)33)14-5-26(56)38(61)27(57)6-14)31-19(49)10-17(47)16-9-28(58)41(65-44(16)31)12-1-22(52)36(59)23(53)2-12/h1-8,10-11,28,34-35,39-43,46-63H,9H2/t28-,34-,35-,39-,40-,41-,42+,43+/m0/s1 |
| SMILES |
Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)C2 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cistaceae | Cistus incanus | Ref. |
| Plantae | Grossulariaceae | Ribes nigrum  | Ref. |
| Plantae | Poaceae | Hordeum vulgare | Ref. |
|
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