input word = C00009761

Metabolite InformationStructural formula
Name Coumestrol dimethyl ether
Di-O-methylcoumestrol
3,9-Dimethylcoumestan
3,9-Dimethoxy-6-oxopterocarpene
Formula C17H12O5
Mw 296.06847349
CAS RN 3172-99-4
C_ID C00009761 ,
InChIKey PXHLPCBBXPHBHP-UHFFFAOYSA-N
InChICode InChI=1S/C17H12O5/c1-19-9-3-5-11-13(7-9)21-16-12-6-4-10(20-2)8-14(12)22-17(18)15(11)16/h3-8H,1-2H3
SMILES c1(ccc2c(c1)oc(=O)c1c2oc2c1ccc(c2)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDalbergia decipularis Ref.
PlantaeFabaceaeSwartzia madagascariensis Ref.
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OrganismDalbergia decipularis
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 517,Isoflavonoids and neoflavonoids

De Alencar,Phytochem.,11,(1972),1517

Harper,J.Chem.Soc.C,(1969),1109