17beta-Hydroxy-6beta-methylandrost-4-en-3-one

Properties Image MNX_ID MNXM33715 reference chebi:79417 formula C20H30O2 global charge 0 mol weight 302.458 InChIKey QRHBXQAFGLVWFW-BEQVDIJNSA-N InChI InChI=1S/C20H30O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h11-12,14-16,18,22H,4-10H2,1-3H3/t12-,14+,15+,16+,18+,19-,20+/m1/s1 SMILES C[C@@H]1C[C@H]2[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 MNX internals InChI (mnx) InChI=1/C20H30O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h11-12,14-16,18,22H,4-10H2,1-3H3/t12-,14+,15+,16+,18+,19-,20+/m1/s1 SMILES (mnx) [CH3:1][C@@H:12]1[CH2:10][C@H:14]2[C@@H:15]3[CH2:4][CH2:5][C@H:18]([OH:22])[C@@:20]3([CH3:3])[CH2:9][CH2:7][C@@H:16]2[C@@:19]2([CH3:2])[CH2:8][CH2:6][C:13](=[O:21])[CH:11]=[C:17]12

Parent-child relations graph

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