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Pregna-5,16-dien-20-one, 3-(acetyloxy)-, (3.beta.)-

View entire compound with spectra: 1 NMR, and 4 MS (GC)

Pregna-5,16-dien-20-one, 3-(acetyloxy)-, (3.beta.)-
SpectraBase Compound ID B2c3YMTjy4W
InChI InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21H,6,8-13H2,1-4H3
InChIKey MZWRIOUCMXPLKV-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C23H32O3
Exact Mass 356.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oS6yo9WF6
Name Pregna-5,16-dien-20-one, 3-(acetyloxy)-, (3.beta.)-
Alternate Name(s) 20-Oxopregna-5,16-dien-3-yl acetate (17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate (17-ethanoyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl) ethanoate (3-beta)-3-(acetyloxy)pregna-5,16-dien-20-one 16,17-Didehydropregnenolone acetate 16-Dehydropregnenolone acetate 20-Oxopregna-5,16-dien-3.beta.-yl acetate 3.beta.-Acetoxy-pregn-5,16-diene-20-one 3.beta.-Acetoxy-pregnan-5,16-dien-20-one 3.beta.-Acetoxypregna-5,16-dien-20-one 5,16-Pregnadien-3-ol-21-one acetate 5,16-Pregnadiene, 3-acetoxy-20-oxo- 5,16-Pregnadiene-3.beta.-ol-20-one acetate Acetic acid (17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl) ester Allopregn-5,16-diene-3.beta.-ol-20-one acetate Dehydropregnenolone acetate Pregna-5,16-dien-20-one, 3-(acetyloxy)-, (3-beta)- Pregna-5,16-dien-20-one, 3.beta.-hydroxy-, acetate Pregnan-5,16-dien-3-ol-20-one acetate BRN 1026798 EINECS 213-558-7 NSC 37741
CAS Registry Number 979-02-2
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Formula C23H32O3
InChI InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21H,6,8-13H2,1-4H3
InChIKey MZWRIOUCMXPLKV-UHFFFAOYSA-N
Molecular Weight 356.506 g/mol
SMILES CC12C(C3C(C4(C)C(CC(CC4)OC(C)=O)=CC3)CC1)CC=C2C(C)=O
SPLASH splash10-0007-6940000000-1746ad4b7b9eaf9236a5
Source of Spectrum EP-1349-0-0
Wiley ID 1346141