input word = C00000703

Metabolite InformationStructural formula
Name Enterolactone
Formula C18H18O4
Mw 298.12050906
CAS RN 78473-71-9
C_ID C00000703 ,
InChIKey HVDGDHBAMCBBLR-CAKDRYDPNA-N
InChICode InChI=1S/C18H18O4/c19-15-5-1-3-12(8-15)7-14-11-22-18(21)17(14)10-13-4-2-6-16(20)9-13/h1-6,8-9,14,17,19-20H,7,10-11H2/t14-,17+/m1/s1
SMILES c1c(cc(cc1)C[C@H]1[C@@H](COC1=O)Cc1cc(ccc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo Sapiens Ref.
--Mammalian lignana Ref.
zoom in