5beta-Stigmastan-3beta-ol, (24S)- structure

5beta-Stigmastan-3beta-ol, (24S)-

(3S,5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

Also Known As: Fucostanol|24-ethylcoprostanol|5beta-Stigmastan-3beta-ol, (24S)-|(24S)-5beta-Stigmastan-3beta-ol|3-Fluoro-2-iodo-benzoic acid|(3S,5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol|(3S,5R,8R,9S,10S,13R,14S,17R)-17-((2R,5S)-5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta(a)phenanthren-3-ol|(3S,5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

CAS: 4736-91-8
Molecular Formula C29H52O
Molecular Weight 416.40182 g/mol
LogP 8.1047
Topological Polar Surface Area 20.23 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
Rotatable Bonds 6
Exact Mass 416.40182
Monoisotopic Mass 416.40182
Heavy Atoms 30
Complexity 582.91266

Chemical Identifiers

CAS Number 4736-91-8
SMILES CC[C@@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C

Product Overview

5beta-Stigmastan-3beta-ol, (24S)- (CAS 4736-91-8), with molecular formula C29H52O and molecular weight 416.40182 g/mol. IUPAC: (3S,5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol.

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