Etiocholenic acid

(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid

Also Known As: Etiocholenic acid|Etienic acid|Finasteride Impurity 52|A-Hydroxy-5-etienic acid|A-Hydroxyetio-5-cholenic acid|KST-1A0404|3-Hydroxy-5-androstene-17-carboxylic acid|3-Hydroxyandrost-5-ene-17-carboxylic acid|J2.822.985B|(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid|Androst-5-ene-17-carboxylicacid, 3-hydroxy-, (3b,17b)-|(3|A,17|A)-3-hydroxyandrost-5-ene-17-carboxylic acid|3beta-Hydroxyandrosta-5-ene-17beta-carboxylic acid|(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid|Androst-5-ene-17-carboxylic acid, 3-hydroxy-, (3beta,17beta)-|Androst-5-ene-17-carboxylic acid, 3-hydroxy-, (3.beta.,17.beta.)-|(1S,2R,5S,10S,11S,14S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadec-7-ene-14-carboxylic acid|(1S,3aS,3bS,7S,9aR,9bS,11aS)-7-hydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1-carboxylic acid|(3S,8S,10R,13S,17S)-3-Hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid

Molecular Formula	C20H30O3
Molecular Weight	318.21948 g/mol
LogP	4.01
Topological Polar Surface Area	57.53 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	1
Exact Mass	318.21948
Heavy Atoms	23
Complexity	553.1

Chemical Identifiers

CAS Number	10325-79-8
SMILES	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)O)CC=C4[C@@]3(CC[C@@H](C4)O)C