5beta-dihydrodeoxycorticosterone

Properties Image MNX_ID MNXM163217 reference chebi:86384 formula C21H32O3 global charge 0 mol weight 332.484 InChIKey USPYDUPOCUYHQL-VEVMSBRDSA-N InChI InChI=1S/C21H32O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h13,15-18,22H,3-12H2,1-2H3/t13-,15+,16+,17+,18-,20+,21+/m1/s1 SMILES C[C@]12CCC(=O)C[C@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C(=O)CO)CC[C@@H]12 MNX internals InChI (mnx) InChI=1/C21H32O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h13,15-18,22H,3-12H2,1-2H3/t13-,15+,16+,17+,18-,20+,21+/m1/s1 SMILES (mnx) [CH3:1][C@:20]12[CH2:9][CH2:7][C:14](=[O:23])[CH2:11][C@H:13]1[CH2:3][CH2:4][C@H:15]1[C@@H:16]3[CH2:5][CH2:6][C@H:18]([C:19]([CH2:12][OH:22])=[O:24])[C@@:21]3([CH3:2])[CH2:10][CH2:8][C@@H:17]12

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1