input word = C00014079

Metabolite InformationStructural formula
Name 2'',6''-Di-O-Acetyl isovitexin
Formula C25H24O12
Mw 516.12677623
CAS RN 172286-93-0
C_ID C00014079 ,
InChIKey KMFYISKCEINRIB-OTKUJDIRNA-N
InChICode InChI=1S/C25H24O12/c1-10(26)34-9-18-21(31)23(33)25(35-11(2)27)24(37-18)20-15(30)8-17-19(22(20)32)14(29)7-16(36-17)12-3-5-13(28)6-4-12/h3-8,18,21,23-25,28,30-33H,9H2,1-2H3/t18-,21-,23+,24+,25-/m1/s1
SMILES c1(oc2c(c(=O)c1)c(c(c(c2)O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)OC(=O)C)O)c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCrotalaria thebaica Ref.
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