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(16Z)-16-[(2-ethyl-3-pyrazolyl)methylidene]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-one

View entire compound with spectra: 1 MS (GC)

(16Z)-16-[(2-ethyl-3-pyrazolyl)methylidene]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-one
SpectraBase Compound ID 9J27yiQ05i
InChI InChI=1S/C25H34N2O2/c1-4-27-18(9-12-26-27)13-16-14-22-20-6-5-17-15-19(28)7-10-24(17,2)21(20)8-11-25(22,3)23(16)29/h5,9,12-13,19-22,28H,4,6-8,10-11,14-15H2,1-3H3/b16-13-
InChIKey FCJZEZIAZQLHTC-SSZFMOIBSA-N
Mol Weight 394.6 g/mol
Molecular Formula C25H34N2O2
Exact Mass 394.262028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DniJTR6v9ZS
Name (16Z)-16-[(2-ethyl-3-pyrazolyl)methylidene]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34N2O2
InChI InChI=1S/C25H34N2O2/c1-4-27-18(9-12-26-27)13-16-14-22-20-6-5-17-15-19(28)7-10-24(17,2)21(20)8-11-25(22,3)23(16)29/h5,9,12-13,19-22,28H,4,6-8,10-11,14-15H2,1-3H3/b16-13-
InChIKey FCJZEZIAZQLHTC-SSZFMOIBSA-N
Molecular Weight 394.559 g/mol
SMILES OC1CC=2C(C3CCC4(C(C3CC2)C\C(C4=O)=C\c2[n](ncc2)CC)C)(CC1)C
SPLASH splash10-0006-4944000000-6e671b8e99a3ec88570b
Synonyms (16Z)-16-[(2-ethylpyrazol-3-yl)methylene]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-one (16Z)-16-[(2-ethylpyrazol-3-yl)methylidene]-10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-one (16Z)-16-[(2-ethylpyrazol-3-yl)methylidene]-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-one
Wiley ID 1445024