input word = C00008905

Metabolite InformationStructural formula
Name Epigallocatechin 3-O-p-coumarate
Formula C24H20O9
Mw 452.11073224
CAS RN 89013-65-0
C_ID C00008905 ,
InChIKey HKPGWUPXXPIOAN-PDVRMILXNA-N
InChICode InChI=1S/C24H20O9/c25-14-4-1-12(2-5-14)3-6-22(30)32-21-11-16-17(27)9-15(26)10-20(16)33-24(21)13-7-18(28)23(31)19(29)8-13/h1-10,21,24-29,31H,11H2/b6-3+/t21-,24-/m1/s1
SMILES c1(cc(c2c(c1)O[C@@H]([C@@H](C2)OC(=O)/C=C/c1ccc(cc1)O)c1cc(c(c(c1)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTheaceaeCamellia sinensis Ref.
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OrganismCamellia sinensis
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Nonaka,Chem.Pharm.Bull,31,(1983),3906