input word = C00008838

Metabolite InformationStructural formula
Name Epicatechin 3-O-beta-D-allopyranoside
Formula C21H24O11
Mw 452.13186161
CAS RN 98819-14-8
C_ID C00008838 ,
InChIKey YOVYWMDLYSJYPO-MGTYQCCUNA-N
InChICode InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-5,15-29H,6-7H2/t15-,16-,17-,18+,19-,20-,21-/m1/s1
SMILES OC[C@H]1O[C@@H](O[C@@H]2Cc3c(O)cc(O)cc3O[C@@H]2c2ccc(O)c(O)c2)C(O)C(O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDavalliaceaeDavallia divaricata Ref.
PlantaeDavalliaceaeDavallia griffithiana Ref.
PlantaeDavalliaceaeDavallia maries Ref.
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OrganismDavallia griffithiana
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Murakami,Yakugaku Zasshi,105,(1985),649

Hwang,Phytochem.,29,(1990),279