input word = C00004936

Metabolite InformationStructural formula
Name 5,2',5'-Trihydroxy-3,7,8-trimethoxyflavone 2'-acetate
Formula C20H18O9
Mw 402.09508217
CAS RN 117259-17-3
C_ID C00004936 ,
InChIKey QLXHITSYJNILTR-UHFFFAOYSA-N
InChICode InChI=1S/C20H18O9/c1-26-13-8-12(22)15-16(25)20(28-3)17(29-19(15)18(13)27-2)11-7-10(21)5-4-9(11)6-14(23)24/h4-5,7-8,21-22H,6H2,1-3H3,(H,23,24)
SMILES c1(cc(c2c(c1OC)oc(c(c2=O)OC)c1cc(ccc1CC(=O)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaeNotholaena aliena Ref.
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