input word = C00008864

Metabolite InformationStructural formula
Name Epiafzelechin 3-O-gallate
Formula C22H18O9
Mw 426.09508217
CAS RN 108907-43-3
C_ID C00008864 ,
InChIKey SDZPYNMXGUHFMZ-VCZXBEBONA-N
InChICode InChI=1S/C22H18O9/c23-12-3-1-10(2-4-12)21-19(9-14-15(25)7-13(24)8-18(14)30-21)31-22(29)11-5-16(26)20(28)17(27)6-11/h1-8,19,21,23-28H,9H2/t19-,21-/m1/s1
SMILES O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)cc1)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTheaceaeCamellia sinensis var. assamica Ref.
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OrganismCamellia sinensis var. assamica
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Hashimoto,Chem.Pharm.Bull.,35,(1987),611