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1α,3β-dihydroxyandrost-5-EN-17-one
SpectraBase Compound ID AAe8kir1E85
InChI InChI=1S/C19H28O3/c1-18-8-7-15-13(14(18)5-6-16(18)21)4-3-11-9-12(20)10-17(22)19(11,15)2/h3,12-15,17,20,22H,4-10H2,1-2H3/t12-,13+,14+,15+,17+,18+,19+/m1/s1
InChIKey WWUWPHTVCBJAFV-DYXPHYEZSA-N
Mol Weight 304.43 g/mol
Molecular Formula C19H28O3
Exact Mass 304.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JbuFofOMCt3
Name (1S,3R,8R,9S,10R,13S,14S)-1,3-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
CAS Registry Number 20998-18-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O3
InChI InChI=1S/C19H28O3/c1-18-8-7-15-13(14(18)5-6-16(18)21)4-3-11-9-12(20)10-17(22)19(11,15)2/h3,12-15,17,20,22H,4-10H2,1-2H3/t12-,13+,14+,15+,17+,18+,19+/m1/s1
InChIKey WWUWPHTVCBJAFV-DYXPHYEZSA-N
Molecular Weight 304.430 g/mol
SMILES O[C@]1(C[C@@](CC=2[C@]1([C@@]1([C@@](CC2)([C@@]2(CCC([C@]2(CC1)C)=O)[H])[H])[H])C)(O)[H])[H]
SPLASH splash10-05mx-8690000000-a93ef362b6dc6d452830
Source of Spectrum H-64-1890-0
Synonyms (1S,3R,8R,9S,10R,13S,14S)-10,13-dimethyl-1,3-bis(oxidanyl)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one 1-Hydroxydehydroepiandrosterone 1-OH-DHAS Androst-5-en-17-one, 1,3-dihydroxy-, (1alpha,3beta)-
Wiley ID 1306710