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3-.beta.-(Acetoxy)-17-.beta.-(5'-ethoxy-2'-thiazolyl)androst-5-ene

View entire compound with spectra: 1 MS (GC)

3-.beta.-(Acetoxy)-17-.beta.-(5'-ethoxy-2'-thiazolyl)androst-5-ene
SpectraBase Compound ID Ex7OhpXjMQW
InChI InChI=1S/C26H37NO3S/c1-5-29-23-15-27-24(31-23)22-9-8-20-19-7-6-17-14-18(30-16(2)28)10-12-25(17,3)21(19)11-13-26(20,22)4/h6,15,18-22H,5,7-14H2,1-4H3/t18-,19-,20-,21-,22+,25-,26-/m0/s1
InChIKey RYQYEQDEDFXQBN-MKPDMXAPSA-N
Mol Weight 443.6 g/mol
Molecular Formula C26H37NO3S
Exact Mass 443.249415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LttJuwyyOu9
Name 3-.beta.-(Acetoxy)-17-.beta.-(5'-ethoxy-2'-thiazolyl)androst-5-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37NO3S
InChI InChI=1S/C26H37NO3S/c1-5-29-23-15-27-24(31-23)22-9-8-20-19-7-6-17-14-18(30-16(2)28)10-12-25(17,3)21(19)11-13-26(20,22)4/h6,15,18-22H,5,7-14H2,1-4H3/t18-,19-,20-,21-,22+,25-,26-/m0/s1
InChIKey RYQYEQDEDFXQBN-MKPDMXAPSA-N
Molecular Weight 443.646 g/mol
SMILES [C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])(CC[C@@]1(c1sc(OCC)cn1)[H])[H])C
SPLASH splash10-054x-0903500000-649eba1aa154f4a2be59
Source of Spectrum SK-23-843-9
Synonyms (3beta,17beta)-17-(5-ethoxy-1,3-thiazol-2-yl)androst-5-en-3-yl acetate Acetic acid[(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxy-2-thiazolyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]ester Acetic acid[(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxythiazol-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]ester [(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxy-1,3-thiazol-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetate [(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxy-1,3-thiazol-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]ethanoate [(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxythiazol-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetate Acetic acid [(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxy-2-thiazolyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxy-1,3-thiazol-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxythiazol-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,8S,9S,10R,13S,14S,17S)-17-(5-ethoxy-1,3-thiazol-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate
Wiley ID 865574