input word = C00009933

Metabolite InformationStructural formula
Name Lupinisoflavone H
Formula C25H26O7
Mw 438.16785319
CAS RN 121747-92-0
C_ID C00009933 ,
InChIKey BBJBSCHGUMCQQR-UHFFFAOYNA-N
InChICode InChI=1S/C25H26O7/c1-12(2)5-6-14-17(26)8-7-13(22(14)27)16-11-31-19-10-18-15(23(28)21(19)24(16)29)9-20(32-18)25(3,4)30/h5,7-8,10-11,20,26-28,30H,6,9H2,1-4H3/t20-/m1/s1
SMILES CC(C)=CCc1c(O)ccc(-c2coc3cc4c(c(O)c3c2=O)CC(C(C)(C)O)O4)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLupinus albus Ref.
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