input word = C00009065

Metabolite InformationStructural formula
Name [3,5,7,4'-Tetrahydroxyflavan-(4->8)]2-3,4,5,7,4'-pentahydroxyflavan
Formula C45H38O16
Mw 834.21598517
CAS RN 25713-96-6
C_ID C00009065 ,
InChIKey PXMVHFKJSCHILV-UHFFFAOYNA-N
InChICode InChI=1S/C45H38O16/c46-20-7-1-17(2-8-20)41-38(56)35(30-24(50)13-23(49)14-29(30)59-41)31-25(51)15-26(52)32-36(39(57)42(60-44(31)32)18-3-9-21(47)10-4-18)33-27(53)16-28(54)34-37(55)40(58)43(61-45(33)34)19-5-11-22(48)12-6-19/h1-16,35-43,46-58H/t35-,36-,37+,38-,39+,40+,41+,42-,43-/m1/s1
SMILES c12c([C@@H]([C@H]([C@@H](O1)c1ccc(cc1)O)O)c1c3c([C@@H]([C@@H]([C@H](O3)c3ccc(cc3)O)O)c3c4c([C@@H]([C@@H]([C@H](O4)c4ccc(cc4)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
PlantaeFabaceaeTamarindus indica Ref.
PlantaeTamaricaceaeTamarix indica Ref.
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OrganismTamarix indica
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Bhatia,Indian J.Chem.,7,(1969),123