input word = C00019079

Metabolite InformationStructural formula
Name Scanderone
4',5-Dihydroxy-3'-prenyl-2'',2''-dimethylchromeno[7,8:6'',5'']isoflavone
Formula C25H24O5
Mw 404.16237388
CAS RN 714951-96-9
C_ID C00019079 ,
InChIKey ICIKOMSKEPJTII-UHFFFAOYSA-N
InChICode InChI=1S/C25H24O5/c1-14(2)5-6-16-11-15(7-8-19(16)26)18-13-29-24-17-9-10-25(3,4)30-21(17)12-20(27)22(24)23(18)28/h5,7-13,26-27H,6H2,1-4H3
SMILES c1c2c(c3c(c1O)c(=O)c(co3)c1ccc(c(c1)CC=C(C)C)O)C=CC(O2)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDerris scandens Ref.
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