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3-OXOANDROST-4-ENE-17-CARBOXYLIC ACID
SpectraBase Compound ID LUnJVViKLww
InChI InChI=1S/C20H28O3/c1-19-9-7-13(21)11-12(19)3-4-14-15-5-6-17(18(22)23)20(15,2)10-8-16(14)19/h11,14-17H,3-10H2,1-2H3,(H,22,23)/t14-,15-,16-,17?,19-,20-/m0/s1
InChIKey YQACAXHKQZCEOI-SCZYCMLPSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol
Enantiomer InChIKey YQACAXHKQZCEOI-LBXXPQGWSA-N
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Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
  • (8S,9S,10R,13S,14S)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid

Mass Spectra of Physiologically Active Substances - including drugs, steroid hormones,and endocrine disruptors 2011

Author: Parr, Maria Kristina; Opfermann, Georg; Schänzer, Wilhelm; Makin, Hugh L. J.

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