input word = C00004252

Metabolite InformationStructural formula
Name Isoscutellarein 4'-methyl ether 7-(6'''-acetylallosyl)(1->2)-glucoside
Formula C30H34O17
Mw 666.17959966
CAS RN
C_ID C00004252 ,
InChIKey NXDNDRJNQJPXGJ-WLTJNIOUNA-N
InChICode InChI=1S/C30H34O17/c1-11(32)42-10-19-22(36)24(38)26(40)29(46-19)47-28-25(39)21(35)18(9-31)45-30(28)44-17-8-15(34)20-14(33)7-16(43-27(20)23(17)37)12-3-5-13(41-2)6-4-12/h3-8,18-19,21-22,24-26,28-31,34-40H,9-10H2,1-2H3/t18-,19-,21+,22+,24+,25+,26-,28-,29+,30-/m1/s1
SMILES c1(cc(c2c(c1O)oc(cc2=O)c1ccc(cc1)OC)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H](O)[C@H](O1)COC(=O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaeVeronica filiformis Ref.
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OrganismVeronica filiformis
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 3.Flavone O-glycosides, John Wiley & Son

Chari,Phytochem.,20,(1981),1977