input word = C00009707

Metabolite InformationStructural formula
Name Equol
7,4'-Dihydroxyisoflavan
Formula C15H14O3
Mw 242.09429431
CAS RN 94105-90-5
C_ID C00009707 ,
InChIKey ADFCQWZHKCXPAJ-UHFFFAOYNA-N
InChICode InChI=1S/C15H14O3/c16-13-4-1-10(2-5-13)12-7-11-3-6-14(17)8-15(11)18-9-12/h1-6,8,12,16-17H,7,9H2/t12-/m1/s1
SMILES c1(ccc2c(c1)OC[C@@H](C2)c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
PlantaeFabaceaeMillettia pendula Ref.
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