17beta-Hydroxy-6alpha,17-dimethylandrost-4-en-3-one

Properties Image MNX_ID MNXM33712 reference chebi:79627 formula C21H32O2 global charge 0 mol weight 316.485 InChIKey VIOHBAKRYSSFFE-YQVBJQERSA-N InChI InChI=1S/C21H32O2/c1-13-11-15-16(19(2)8-5-14(22)12-18(13)19)6-9-20(3)17(15)7-10-21(20,4)23/h12-13,15-17,23H,5-11H2,1-4H3/t13-,15+,16-,17-,19+,20-,21-/m0/s1 SMILES C[C@H]1C[C@@H]2[C@H](CC[C@@]3(C)[C@H]2CC[C@]3(C)O)[C@@]2(C)CCC(=O)C=C12 MNX internals InChI (mnx) InChI=1/C21H32O2/c1-13-11-15-16(19(2)8-5-14(22)12-18(13)19)6-9-20(3)17(15)7-10-21(20,4)23/h12-13,15-17,23H,5-11H2,1-4H3/t13-,15+,16-,17-,19+,20-,21-/m0/s1 SMILES (mnx) [CH3:1][C@H:13]1[CH2:11][C@@H:15]2[C@H:16]([CH2:6][CH2:9][C@@:20]3([CH3:3])[C@H:17]2[CH2:7][CH2:10][C@:21]3([CH3:4])[OH:23])[C@@:19]2([CH3:2])[CH2:8][CH2:5][C:14](=[O:22])[CH:12]=[C:18]12

Parent-child relations graph

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