input word = C00013996

Metabolite InformationStructural formula
Name Tridaxidone
5,7,2'-Trihydroxy-3,6,4'-trimethoxyflavone 7-glucoside
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(2-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-4H-1-benzopyran-4-one
Formula C24H26O13
Mw 522.13734092
CAS RN 439147-54-3
C_ID C00013996 ,
InChIKey GGWQEKOBVMCBHI-QOFGLXMFNA-N
InChICode InChI=1S/C24H26O13/c1-32-9-4-5-10(11(26)6-9)21-23(34-3)18(29)15-12(35-21)7-13(22(33-2)17(15)28)36-24-20(31)19(30)16(27)14(8-25)37-24/h4-7,14,16,19-20,24-28,30-31H,8H2,1-3H3/t14-,16-,19+,20-,24-/m1/s1
SMILES c1(c(ccc(c1)OC)c1oc2c(c(=O)c1OC)c(c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTridax procumbens Ref.
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