input word = C00008248

Metabolite InformationStructural formula
Name Bavachinin
Formula C21H22O4
Mw 338.15180919
CAS RN 19879-30-2
C_ID C00008248 ,
InChIKey VOCGSQHKPZSIKB-UHFFFAOYNA-N
InChICode InChI=1S/C21H22O4/c1-13(2)4-5-15-10-17-18(23)11-20(14-6-8-16(22)9-7-14)25-21(17)12-19(15)24-3/h4,6-10,12,20,22H,5,11H2,1-3H3/t20-/m1/s1
SMILES COc1cc2c(cc1CC=C(C)C)C(=O)CC(c1ccc(O)cc1)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePsoralea corylifolia Ref.
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