input word = C00005402

Metabolite InformationStructural formula
Name Quercetin 3-apiosyl-(1->2)-glucoside
Formula C26H28O16
Mw 596.13773485
CAS RN 99882-09-4
C_ID C00005402 ,
InChIKey QJWRRPPVKXMSJD-FSEBXMNRNA-N
InChICode InChI=1S/C26H28O16/c27-6-15-17(33)19(35)22(42-25-23(36)26(37,7-28)8-38-25)24(40-15)41-21-18(34)16-13(32)4-10(29)5-14(16)39-20(21)9-1-2-11(30)12(31)3-9/h1-5,15,17,19,22-25,27-33,35-37H,6-8H2/t15-,17-,19+,22-,23-,24+,25+,26-/m1/s1
SMILES O=c1c(O[C@@H]2OC(CO)[C@@H](O)C(O)C2O[C@@H]2OCC(O)(CO)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaeSecuridaca diversifolia Ref.
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OrganismSecuridaca diversifolia
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Hamburger,Phytochem.,24,(1985),2689

Williams,Phytochem.,36,(1994),931