3-Methoxy-D-homoestra-1,3,5(10),8,14-pentaen-17abeta-ol

Properties Image MNX_ID MNXM36598 reference chebi:79583 formula C20H24O2 global charge 0 mol weight 296.41 InChIKey GCSVNNSSUFCOCR-PMACEKPBSA-N InChI InChI=1S/C20H24O2/c1-20-11-10-16-15-9-7-14(22-2)12-13(15)6-8-17(16)18(20)4-3-5-19(20)21/h4,7,9,12,19,21H,3,5-6,8,10-11H2,1-2H3/t19-,20-/m0/s1 SMILES COC1=CC2=C(C=C1)C1=C(CC2)C2=CCC[C@H](O)[C@@]2(C)CC1 MNX internals InChI (mnx) InChI=1/C20H24O2/c1-20-11-10-16-15-9-7-14(22-2)12-13(15)6-8-17(16)18(20)4-3-5-19(20)21/h4,7,9,12,19,21H,3,5-6,8,10-11H2,1-2H3/t19-,20-/m0/s1 SMILES (mnx) [CH3:1][C@:20]12[CH2:11][CH2:10][C:16]3=[C:17]([CH2:8][CH2:6][C:13]4=[CH:12][C:14]([O:22][CH3:2])=[CH:7][CH:9]=[C:15]43)[C:18]1=[CH:4][CH2:3][CH2:5][C@@H:19]2[OH:21]

Parent-child relations graph

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