5-alpha-Pregnan-3-alpha-amine, acetate structure

5-alpha-Pregnan-3-alpha-amine, acetate

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

Also Known As: 3-alpha-Aminopregnane acetate|Acetate de 3 alpha-amino-pregnane|5-alpha-Pregnan-3-alpha-amine, acetate|KST-1A3681|Acetate de 3 alpha-amino-pregnane [French]|Acetic acid--pregnan-3-amine (1/1)|(3|A,5|A)-pregnan-3-amine acetate(1:1)|Acetic acid--5alpha-pregnan-3alpha-amine (1/1)|acetic acid; (3R,5S,8S,9S,10S,13R,14S,17S)-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine

CAS: 31075-58-8
Molecular Formula C23H41NO2
Molecular Weight 363.31372 g/mol
LogP 5.4735
Topological Polar Surface Area 63.3 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 1
Exact Mass 363.31372
Monoisotopic Mass 363.31372
Heavy Atoms 26
Complexity 463.0

Chemical Identifiers

CAS Number 31075-58-8
SMILES CC[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)N)C)C.CC(=O)O
InChIKey JEIDUNUFDJGJOF-FVWCGPCDSA-N

Product Overview

5-alpha-Pregnan-3-alpha-amine, acetate (CAS 31075-58-8), with molecular formula C23H41NO2 and molecular weight 363.31372 g/mol. IUPAC: acetic acid;(3R,5S,8S,9S,10S,13R,14S,17S)-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine.

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