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5.ALPHA.-ANDROSTANE-11.ALPHA.,16.ALPHA.-DIOL-3-ONE-11.ALPHA.,16.ALPHA.-DI-ACETATE
SpectraBase Compound ID JpMiYwpuchV
InChI InChI=1S/C23H34O5/c1-13(24)27-17-10-19-18-6-5-15-9-16(26)7-8-23(15,4)21(18)20(28-14(2)25)12-22(19,3)11-17/h15,17-21H,5-12H2,1-4H3/t15-,17+,18-,19-,20+,21+,22-,23-/m0/s1
InChIKey NZNXOVKWQHEFKE-ZZNDGULVSA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EN3ePGhfeX0
Name 5.ALPHA.-ANDROSTANE-11.ALPHA.,16.ALPHA.-DIOL-3-ONE-11.ALPHA.,16.ALPHA.-DI-ACETATE
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Exact Mass 390.240624190 u
Formula C23H34O5
InChI InChI=1S/C23H34O5/c1-13(24)27-17-10-19-18-6-5-15-9-16(26)7-8-23(15,4)21(18)20(28-14(2)25)12-22(19,3)11-17/h15,17-21H,5-12H2,1-4H3/t15-,17+,18-,19-,20+,21+,22-,23-/m0/s1
InChIKey NZNXOVKWQHEFKE-ZZNDGULVSA-N
Molecular Weight 390.520 g/mol
Nominal Mass 390 u
Number of Peaks 49
SMILES C1(CC[C@@]2([C@]3([C@@](C[C@@]4(C[C@@](C[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])(OC(C)=O)[H])C)(OC(C)=O)[H])[H])C)=O
SPLASH splash10-05i0-3590000000-5be20925d5fa9432bc55
Source File Reference LMCM-91044-166Y
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 11-(ACETYLOXY)-3-OXOANDROSTAN-16-YL ACETATE (5S,8S,9S,10S,11R,13S,14S,16R)-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthrene-11,16-diyl diacetate
Wiley ID 4_2575