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(3S,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(E,3E)-3-propoxyiminoprop-1-enyl]-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol

View entire compound with spectra: 1 MS (GC)

(3S,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(E,3E)-3-propoxyiminoprop-1-enyl]-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol
SpectraBase Compound ID K7hFJz7eHiD
InChI InChI=1S/C25H41NO3/c1-4-16-29-26-15-5-6-18-9-14-25(28)22-8-7-19-17-20(27)10-12-23(19,2)21(22)11-13-24(18,25)3/h5-6,15,18-22,27-28H,4,7-14,16-17H2,1-3H3/b6-5+,26-15+/t18-,19+,20-,21-,22+,23-,24+,25-/m0/s1
InChIKey DQYJLZOJHXQMRC-LBFRTFKHSA-N
Mol Weight 403.6 g/mol
Molecular Formula C25H41NO3
Exact Mass 403.308644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D7vy542AA19
Name (3S,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(E,3E)-3-propoxyiminoprop-1-enyl]-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H41NO3
InChI InChI=1S/C25H41NO3/c1-4-16-29-26-15-5-6-18-9-14-25(28)22-8-7-19-17-20(27)10-12-23(19,2)21(22)11-13-24(18,25)3/h5-6,15,18-22,27-28H,4,7-14,16-17H2,1-3H3/b6-5+,26-15+/t18-,19+,20-,21-,22+,23-,24+,25-/m0/s1
InChIKey DQYJLZOJHXQMRC-LBFRTFKHSA-N
Molecular Weight 403.607 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@@]([C@@]3(CC[C@@]2(C1)[H])[H])(CC[C@@]4(\C=C\C=N\OCCC)[H])O)C)[H])C)[H]
SPLASH splash10-0f6x-9070100000-1a027071043a2e19e674
Source of Spectrum F2-43-2343-15
Synonyms (3S,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(E,3E)-3-propyloximinoprop-1-enyl]-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol
Wiley ID 1600738