(S)-Indenestrol A

Properties Image MNX_ID MNXM31847 reference chebi:34021 formula C18H18O2 global charge 0 mol weight 266.34 InChIKey BBOUFHMHCBZYJJ-NSHDSACASA-N InChI InChI=1S/C18H18O2/c1-3-15-16-9-8-14(20)10-17(16)11(2)18(15)12-4-6-13(19)7-5-12/h4-11,19-20H,3H2,1-2H3/t11-/m0/s1 SMILES CCC1=C(C2=CC=C(O)C=C2)[C@@H](C)C2=CC(O)=CC=C21 MNX internals InChI (mnx) InChI=1/C18H18O2/c1-3-15-16-9-8-14(20)10-17(16)11(2)18(15)12-4-6-13(19)7-5-12/h4-11,19-20H,3H2,1-2H3/t11-/m0/s1 SMILES (mnx) [CH3:1][CH2:3][C:15]1=[C:18]([C:12]2=[CH:5][CH:7]=[C:13]([OH:19])[CH:6]=[CH:4]2)[C@@H:11]([CH3:2])[C:17]2=[C:16]1[CH:9]=[CH:8][C:14]([OH:20])=[CH:10]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0