input word = C00006304

Metabolite InformationStructural formula
Name Embigenin 2''-(2'''-acetylrhamnoside)
Formula C31H36O15
Mw 648.20542048
CAS RN 94805-88-6
C_ID C00006304 ,
InChIKey ZSQIFROPCHIGKD-LNRNZUQFNA-N
InChICode InChI=1S/C31H36O15/c1-12-23(35)26(38)30(43-13(2)33)31(42-12)46-29-27(39)24(36)20(11-32)45-28(29)22-18(41-4)10-19-21(25(22)37)16(34)9-17(44-19)14-5-7-15(40-3)8-6-14/h5-10,12,20,23-24,26-32,35-39H,11H2,1-4H3/t12-,20-,23+,24+,26+,27+,28+,29+,30-,31+/m1/s1
SMILES COc1ccc(-c2cc(=O)c3c(O)c([C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O[C@@H]4OC(C)[C@H](O)[C@H](O)C4OC(C)=O)c(OC)cc3o2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris lactea Ref.
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OrganismIris lactea
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 549,C-glycosylflavones

Pryakhina,Khim.Prir.Soedin.,(1984),589