input word = C00005300

Metabolite InformationStructural formula
Name Fisetin 3-glucoside
Formula C21H20O11
Mw 448.10056148
CAS RN 20633-87-8
C_ID C00005300 ,
InChIKey VKVJRSCYKAOTEB-YNICKFHTNA-N
InChICode InChI=1S/C21H20O11/c22-7-14-16(27)17(28)18(29)21(31-14)32-20-15(26)10-3-2-9(23)6-13(10)30-19(20)8-1-4-11(24)12(25)5-8/h1-6,14,16-18,21-25,27-29H,7H2/t14-,16-,17-,18-,21+/m1/s1
SMILES O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)ccc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeBaptisia calycosa Ref.
PlantaeFabaceaeBaptisia leucantha Ref.
PlantaeFabaceaeBaptisia simplicifolia Ref.
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OrganismBaptisia simplicifolia
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Markham,Phytochem.,7,(1968),791

Markham,Phytochem.,9,(1970),2359