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|5-Androstenediol-3-acetate
5-Androstenediol-3-acetate
Names: 5-Androstenediol-3-acetate (primary)
Acetic acid [(3S,8R,9R,10S,13R,14R,17S)-17-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester (IUPAC CAS-like; IUPAC traditional)
(3β,17β)-17-Hydroxyandrost-5-en-3-yl acetate (IUPAC ACD/Name)
[(3S,8R,9R,10S,13R,14R,17S)-17-Hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate (IUPAC allowed; IUPAC preferred)
[(3S,8R,9R,10S,13R,14R,17S)-17-Hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate (IUPAC systematic)
Molecular formula: C21H32O3
Nominal mass: 332
Average mass: 332.4770
Monoisotopic mass: 332.235145
CAS registry number: 1639-43-6
ChemSpider: 92284
PubChem: 40513363 40513359 16401469 14320346 11876081 11876080 11876079 11739071 9818996 102150 908587 908585
Wikipedia: 5-androstenediol
Erowid: Steroids
Standard InChI: InChI=1S/C21H32O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,15-19,23H,5-12H2,1-3H3/t15-,16-,17-,18-,19-,20-,21-/m0/s1
Standard InChIKey: OQHMNEGOKQMOFM-BPSSIEEOSA-N
SMILES: CC(=O)O[C@H]1CC[C@]2(C)C(=CC[C@H]3[C@H]4CC[C@H]([C@]4(C)CC[C@H]23)O)C1
Tags: steroid ester
 
Property Value Remarks
Property Value Remarks
Location Type Remarks
5-androstenediol-3-acetate.pdf EI MS UV FTIR Used with permission of CND Analytical. From "Analytical Profiles of the Anabolic Steroids"
5-Androstenediol-3-acetate -Mass.jdx mass spectrum NIST Mass Spectrometry Data Center Collection (C) 2008 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved.
Vendor ID URL
Vendor ID URL
Title Publication Date Vol. Iss. Page(s) Remarks
Title Publication Date Vol. Iss. Page(s) Remarks
Database ID URL
Instrumental Data for Drug Analysis 3rd Edition Vol 1 Pg 158
Analytical Profiles of The Anabolic Steroids CND Analytical 1989 Pg 43
Spectral Data for Steroids, Edited by Frenkel and Marsh, TRC Data Series, 1994 ISBN 1-883400-00-7 Pg 147
Substance name
5-Androstenediol
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