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(3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-(4-propoxy-1,3-thiazol-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

View entire compound with spectra: 1 MS (GC)

(3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-(4-propoxy-1,3-thiazol-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID DzQBlb7ObaF
InChI InChI=1S/C25H37NO2S/c1-4-13-28-22-15-29-23(26-22)21-8-7-19-18-6-5-16-14-17(27)9-11-24(16,2)20(18)10-12-25(19,21)3/h5,15,17-21,27H,4,6-14H2,1-3H3/t17-,18-,19-,20-,21+,24-,25-/m0/s1
InChIKey KREVDQWIPOJXTD-ROKGUJHPSA-N
Mol Weight 415.6 g/mol
Molecular Formula C25H37NO2S
Exact Mass 415.254501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HD2eZ9sOeyL
Name (3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-(4-propoxy-1,3-thiazol-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H37NO2S
InChI InChI=1S/C25H37NO2S/c1-4-13-28-22-15-29-23(26-22)21-8-7-19-18-6-5-16-14-17(27)9-11-24(16,2)20(18)10-12-25(19,21)3/h5,15,17-21,27H,4,6-14H2,1-3H3/t17-,18-,19-,20-,21+,24-,25-/m0/s1
InChIKey KREVDQWIPOJXTD-ROKGUJHPSA-N
Molecular Weight 415.636 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@@](c5nc(cs5)OCCC)(CC[C@]4([C@@]3(CC=C2C1)[H])[H])[H])C)[H])C)[H]
SPLASH splash10-0q29-0900700000-bcd47c83e90cf09dc3f6
Source of Spectrum SK-23-839-6
Synonyms (3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-(4-propoxy-2-thiazolyl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-(4-propoxythiazol-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID 865568