input word = C00008846

Metabolite InformationStructural formula
Name Catechin-5-O-beta-D-glucopyranoside
(+)-Catechin-5-O-beta-D-glucopyranoside
Formula C21H24O11
Mw 452.13186161
CAS RN 88126-53-8
C_ID C00008846 ,
InChIKey ZESJTWVSXGZYTD-GJOVBANBNA-N
InChICode InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-5-9(23)4-14-10(15)6-13(26)20(30-14)8-1-2-11(24)12(25)3-8/h1-5,13,16-29H,6-7H2/t13-,16-,17+,18-,19+,20+,21+/m0/s1
SMILES OCC1O[C@@H](Oc2cc(O)cc3c2C[C@H](O)[C@@H](c2ccc(O)c(O)c2)O3)C(O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDavalliaceaeDavallia griffithiana Ref.
PlantaeHypericaceaeHypericum erectum Thunb. Ref.
PlantaePolygonaceaePolygonum cuspidatum Ref.
PlantaePolygonaceaeRheum sp. Ref.
PlantaePolygonaceaeRheum spp. Ref.
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OrganismDavallia griffithiana
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Nonaka,Phytochem.,22,(1983),1659

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