input word = C00006405

Metabolite InformationStructural formula
Name Polygonatiin
Vitexin 2''-O-sophoroside
Formula C33H40O20
Mw 756.21129372
CAS RN 61360-93-8
C_ID C00006405 ,
InChIKey CRMYONWTUPGSBF-WZHRYUOVNA-N
InChICode InChI=1S/C33H40O20/c34-7-16-22(42)25(45)30(52-33-31(26(46)23(43)18(9-36)51-33)53-32-27(47)24(44)21(41)17(8-35)50-32)29(49-16)20-13(39)5-12(38)19-14(40)6-15(48-28(19)20)10-1-3-11(37)4-2-10/h1-6,16-18,21-27,29-39,41-47H,7-9H2/t16-,17+,18-,21-,22-,23-,24+,25+,26+,27-,29+,30+,31-,32+,33+/m1/s1
SMILES O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O[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
PlantaeConvallariaceaePolygonatum odoratum Ref.
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OrganismPolygonatum odoratum
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 549,C-glycosylflavones

Morita,J.Pharm.Soc.Japan,96,(1976),1180