3beta,21-Dihydroxy-4,4,14-trimethyl-5alpha-pregn-8-en-20-one

Properties Image MNX_ID MNXM36944 reference chebi:79514 formula C24H38O3 global charge 0 mol weight 374.565 InChIKey KUZAKLLYYNJTRA-CEGYNPMNSA-N InChI InChI=1S/C24H38O3/c1-21(2)19-7-6-16-15(22(19,3)11-10-20(21)27)8-12-24(5)17(18(26)14-25)9-13-23(16,24)4/h17,19-20,25,27H,6-14H2,1-5H3/t17-,19+,20+,22-,23+,24-/m1/s1 SMILES CC1(C)[C@@H](O)CC[C@]2(C)C3=C(CC[C@@H]12)[C@]1(C)CC[C@H](C(=O)CO)[C@@]1(C)CC3 MNX internals InChI (mnx) InChI=1/C24H38O3/c1-21(2)19-7-6-16-15(22(19,3)11-10-20(21)27)8-12-24(5)17(18(26)14-25)9-13-23(16,24)4/h17,19-20,25,27H,6-14H2,1-5H3/t17-,19+,20+,22-,23+,24-/m1/s1 SMILES (mnx) [CH3:1][C:21]1([CH3:2])[C@@H:19]2[CH2:7][CH2:6][C:16]3=[C:15]([CH2:8][CH2:12][C@:24]4([CH3:5])[C@@H:17]([C:18]([CH2:14][OH:25])=[O:26])[CH2:9][CH2:13][C@@:23]34[CH3:4])[C@@:22]2([CH3:3])[CH2:11][CH2:10][C@@H:20]1[OH:27]

Parent-child relations graph

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