input word = C00006114

Metabolite InformationStructural formula
Name 3'-C-Glucosylisoliquiritigenin
Formula C21H22O9
Mw 418.1263823
CAS RN 64052-96-6
C_ID C00006114 ,
InChIKey MZVNOJAOJRNZHT-GREWHUCENA-N
InChICode InChI=1S/C21H22O9/c22-9-15-18(27)19(28)20(29)21(30-15)16-14(25)8-6-12(17(16)26)13(24)7-3-10-1-4-11(23)5-2-10/h1-8,15,18-23,25-29H,9H2/b7-3+/t15-,18+,19+,20-,21+/m1/s1
SMILES c1(c(c(c(cc1)C(=O)/C=C/c1ccc(cc1)O)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
PlantaeFabaceaeCladrastis platycarpa Ref.
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