input word = C00013931

Metabolite InformationStructural formula
Name Quercetin 3,4'-dimethyl ether 7-glucoside
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-4H-1-benzopyran-4-one
Formula C23H24O12
Mw 492.12677623
CAS RN 70324-45-7
C_ID C00013931 ,
InChIKey DBZKCUWFRLLAMD-LELXAFLNNA-N
InChICode InChI=1S/C23H24O12/c1-31-13-4-3-9(5-11(13)25)21-22(32-2)18(28)16-12(26)6-10(7-14(16)34-21)33-23-20(30)19(29)17(27)15(8-24)35-23/h3-7,15,17,19-20,23-27,29-30H,8H2,1-2H3/t15-,17-,19+,20-,23-/m1/s1
SMILES c1c(cc(c(c1)OC)O)c1oc2c(c(=O)c1OC)c(cc(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDilleniaceaeDillenia indica Ref.
PlantaeRutaceaeZanthoxylum bungeanum Ref.
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