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(3S,5R,8R,9S,10S,13R,14S,17S)-17-[(E)-3-(dimethylamino)propoxyiminomethyl]-10,13-dimethyl-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,17S)-17-[(E)-3-(dimethylamino)propoxyiminomethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol
SpectraBase Compound ID FLKfJ4XXnQQ
InChI InChI=1S/C25H44N2O3/c1-23-11-9-20(28)16-18(23)6-7-22-21(23)10-12-24(2)19(8-13-25(22,24)29)17-26-30-15-5-14-27(3)4/h17-22,28-29H,5-16H2,1-4H3/b26-17+/t18-,19-,20+,21+,22-,23+,24-,25+/m1/s1
InChIKey GWVOOOKBHJEJJJ-BTFOIUJMSA-N
Mol Weight 420.6 g/mol
Molecular Formula C25H44N2O3
Exact Mass 420.335193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99V007qKrWL
Name (3S,5R,8R,9S,10S,13R,14S,17S)-17-[(E)-3-(dimethylamino)propoxyiminomethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol
Alternate Name(s) (3S,5R,8R,9S,10S,13R,14S,17S)-17-[(E)-3-(dimethylamino)propyloximinomethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H44N2O3
InChI InChI=1S/C25H44N2O3/c1-23-11-9-20(28)16-18(23)6-7-22-21(23)10-12-24(2)19(8-13-25(22,24)29)17-26-30-15-5-14-27(3)4/h17-22,28-29H,5-16H2,1-4H3/b26-17+/t18-,19-,20+,21+,22-,23+,24-,25+/m1/s1
InChIKey GWVOOOKBHJEJJJ-BTFOIUJMSA-N
Molecular Weight 420.638 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=N\OCCCN(C)C)[H])O)C)[H])C)[H]
SPLASH splash10-0fk9-9006000000-53869191c516f6969209
Source of Spectrum F2-43-2342-5
Wiley ID 1600748