input word = C00009927

Metabolite InformationStructural formula
Name Lupinisoflavone M
Formula C25H28O8
Mw 456.17841787
CAS RN 128700-28-7
C_ID C00009927 ,
InChIKey IXEGNYHOJYAEHW-UHFFFAOYNA-N
InChICode InChI=1S/C25H28O8/c1-24(2,30)19(27)9-14-16(26)10-18-21(22(14)28)23(29)15(11-32-18)12-5-6-17-13(7-12)8-20(33-17)25(3,4)31/h5-7,10-11,19-20,26-28,30-31H,8-9H2,1-4H3/t19-,20-/m1/s1
SMILES c1(c(c(c2c(c1)occ(c2=O)c1ccc2c(c1)C[C@@H](O2)C(C)(C)O)O)C[C@H](C(C)(C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLupinus albus Ref.
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