input word = C00004507

Metabolite InformationStructural formula
Name Diosmetin 3'-glucoside
Formula C22H22O11
Mw 462.11621155
CAS RN 141360-86-3
C_ID C00004507 ,
InChIKey VSFKAJPKOFGJTH-BLSWNQSENA-N
InChICode InChI=1S/C22H22O11/c1-30-13-3-2-9(14-7-12(26)18-11(25)5-10(24)6-16(18)31-14)4-15(13)32-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20-,21+,22-/m1/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1cc(c(cc1)OC)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCassia torosa Ref.
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