5alpha-Pregnan-20alpha-ol-3-one structure

5alpha-Pregnan-20alpha-ol-3-one

(5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

Also Known As: 20-Ahapo|Allopregnan-20alpha-ol-3-one|Allopregnan-20beta-ol-3-one|5alpha-Pregnan-20alpha-ol-3-one|5a-Pregnane-3-one-20a-ol|20-Hydroxypregnan-3-one|20alpha-Hydroxy-5alpha-pregnan-3-one|Allopregnan-20a-ol-3-one|5alpha-Pregnane-3-one-20alpha-ol|5alpha-pregnan-20Beta-ol-3-one|20beta-Hydroxy-5alpha-pregnan-3-one|allopregnan-20 beta-ol-3-one|allopregnan-20 alpha-ol-3-one|Allopregnan-20-alpha-ol-3-one|5A-PREGNAN-20A-OL-3-ONE|20S-Hydroxy-5alpha-pregnan-3-one|Pregnan-3-one, 20-hydroxy-, (5alpha,20S)-|(20S)-20-Hydroxy-5alpha-pregnan-3-one|20 beta-hydroxy-5 alpha-pregnan-3-one|20 alpha-hydroxy-5 alpha-pregnan-3-one|20-alpha-hydroxy-5-alpha-pregnan-3-one|5 alpha -Pregnane-3-one-20 alpha -ol|ALLOPREGNAN-20.ALPHA.-OL-3-ONE|(5alpha,20S)-20-Hydroxypregnan-3-one|(5-alpha,20S)-20-Hydroxypregnan-3-one|SID:249815125|allopregnan-20 alpha-ol-3-one, (20S)-isomer|ALLOPREGNAN-20.ALPHA.-OL-3-ONE [MI]|allopregnan-20 alpha-ol-3-one, (5alpha)-isomer|5.ALPHA.,20.ALPHA.-TETRAHYDROPROGESTERONE|allopregnan-20 alpha-ol-3-one, (5alpha,20R)-isomer|allopregnan-20 alpha-ol-3-one, (5beta,20R)-isomer

CAS: 516-59-6
Molecular Formula C21H34O2
Molecular Weight 318.2559 g/mol
LogP 4.5952
Topological Polar Surface Area 37.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 1
Exact Mass 318.2559
Monoisotopic Mass 318.2559
Heavy Atoms 23
Complexity 498.07004

Chemical Identifiers

CAS Number 516-59-6
SMILES C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C)O

Product Overview

5alpha-Pregnan-20alpha-ol-3-one (CAS 516-59-6), with molecular formula C21H34O2 and molecular weight 318.2559 g/mol. IUPAC: (5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one.

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