input word = C00006075

Metabolite InformationStructural formula
Name Gossypetin 8-glucoside-3-sulfate
Formula C21H20O16S
Mw 560.04720532
CAS RN 63109-35-3
C_ID C00006075 ,
InChIKey DMAOYRIREVHKFQ-WKIMLYJMNA-N
InChICode InChI=1S/C21H20O16S/c22-5-11-13(27)15(29)16(30)21(34-11)36-18-10(26)4-9(25)12-14(28)20(37-38(31,32)33)17(35-19(12)18)6-1-2-7(23)8(24)3-6/h1-4,11,13,15-16,21-27,29-30H,5H2,(H,31,32,33)/t11-,13-,15+,16-,21+/m1/s1
SMILES O=c1c(OS(=O)(=O)O)c(-c2ccc(O)c(O)c2)oc2c(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c(O)cc(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeMalva sylvestris Ref.
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OrganismMalva sylvestris
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Newwar,Phytochem.,16,(1977),145