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«13β-Ethyl-17β-hydroxygon-4-en-3-one»
13β-Ethyl-17β-hydroxygon-4-en-3-one
CSA Names: 13β-Ethyl-17β-hydroxygon-4-en-3-one
CSA Location: Schedule III Section (f) Subsection (1.0)(25)
CSA History: 71 FR 60426 replacement for “[Reserved]” effective 13 Oct 2006
77 FR 4228 renumbered effective 27 Jan 2012
Names: (8R,9S,10R,14S)-13-Ethyl-17-hydroxy-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one (IUPAC allowed; IUPAC CAS-like; IUPAC preferred; IUPAC systematic; IUPAC traditional)
(8R,9S,10R,13S,14S,17S)-13-Ethyl-17-hydroxy-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one (non-preferred name) (IUPAC ACD/Name)
Molecular formula: C19H28O2
Nominal mass: 288
Average mass: 288.4244
Monoisotopic mass: 288.208930
CAS registry number: 793-54-4
ChemSpider: 8215338
PubChem: 150854
Wikipedia:
Erowid: Steroids
Standard InChI: InChI=1S/C19H28O2/c1-2-19-10-9-15-14-6-4-13(20)11-12(14)3-5-16(15)17(19)7-8-18(19)21/h11,14-18,21H,2-10H2,1H3/t14-,15+,16+,17-,18-,19-/m0/s1
Standard InChIKey: FBYZQDCRLYHHHP-ZOFHRBRSSA-N
SMILES: CC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4CC[C@@H]3[C@H]1CC[C@H]2O
Tags: USCSA
 
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