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2,3-Epoxy-5H-cyclopenta[a]phenanthrene, androstane-5,17-diol deriv.
SpectraBase Compound ID BK8Lkt7os0X
InChI InChI=1S/C19H30O3/c1-17-7-6-13-11(12(17)3-4-16(17)20)5-8-19(21)10-15-14(22-15)9-18(13,19)2/h11-16,20-21H,3-10H2,1-2H3/t11-,12-,13-,14+,15-,16-,17-,18+,19+/m0/s1
InChIKey RYCBXRNRCQTOAZ-BNEJYAGNSA-N
Mol Weight 306.45 g/mol
Molecular Formula C19H30O3
Exact Mass 306.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DOyWvO2Xcf
Name 2,3-Epoxy-5H-cyclopenta[a]phenanthrene, androstane-5,17-diol deriv.
Alternate Name(s) Androstane-5,17-diol, 2,3-epoxy-, (2.alpha.,3.alpha.,5.alpha.,17.bet a.)- (1S,3aS,3bS,5aR,6aS,7aR,8aR,8bS,10aS)-8a,10a-dimethylhexadecahydro-5aH-cyclopenta[7,8]phenanthro[2,3-b]oxirene-1,5a-diol 2.alpha.,3.alpha.-epoxy-5.alpha.-androstane-5,17.beta.-diol
CAS Registry Number 117926-10-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O3
InChI InChI=1S/C19H30O3/c1-17-7-6-13-11(12(17)3-4-16(17)20)5-8-19(21)10-15-14(22-15)9-18(13,19)2/h11-16,20-21H,3-10H2,1-2H3/t11-,12-,13-,14+,15-,16-,17-,18+,19+/m0/s1
InChIKey RYCBXRNRCQTOAZ-BNEJYAGNSA-N
Molecular Weight 306.446 g/mol
SMILES O[C@]1(CC[C@]2([C@]3([C@@]([C@@]4([C@@](CC3)(C[C@@]3(O[C@@]3(C4)[H])[H])O)C)(CC[C@]12C)[H])[H])[H])[H]
SPLASH splash10-052r-3190000000-6855825fe5d28afc073d
Source of Spectrum KC-1988-2030-5
Wiley ID 1308417