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3b-Acetoxy-5b-pregn-16-en-20-one
SpectraBase Compound ID 3l5kANMruxD
InChI InChI=1S/C23H34O3/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/h7,16-18,20-21H,5-6,8-13H2,1-4H3
InChIKey YFMSIVMSEGIVCP-UHFFFAOYSA-N
Mol Weight 358.5 g/mol
Molecular Formula C23H34O3
Exact Mass 358.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2h2rm4ajWi
Name Pregn-16-en-20-one, 3-(acetyloxy)-, (3.beta.,5.beta.)-
CAS Registry Number 56193-61-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O3
InChI InChI=1S/C23H34O3/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/h7,16-18,20-21H,5-6,8-13H2,1-4H3
InChIKey YFMSIVMSEGIVCP-UHFFFAOYSA-N
Molecular Weight 358.522 g/mol
SMILES C1(CCC2(C)C(C1)CCC1C2CCC2(C)C1CC=C2C(C)=O)OC(=O)C
SPLASH splash10-052f-9842000000-366ea701306235220462
Source of Spectrum EP-1354-0-0
Synonyms 20-Oxopregn-16-en-3-yl acetate (17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate (17-ethanoyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) ethanoate 16-Allopregnane-3.beta.-ol-20-one acetate 16-Allopregnene-3.beta.-ol-20-one acetate 16-Pregnen-3.beta.-ol-20-one acetate 16-Pregnene-3.beta.-ol-20-one 16-Pregnene-3.beta.-ol-20-one, acetate 3-Acetoxy-16-pregnenolone Pregn-16-en-20-one, 3-(acetyloxy)-, (3.alpha.)- 3.beta.-Acetoxy-16-allopregnene-20-one 5.alpha.-16-Pregnen-3.beta.-ol, 20-oxo, acetate 5.alpha.-16-Pregnen-3.beta.-ol-20-ol acetate 5.beta.-Pregn-16-en-20-one, 3.beta.-hydroxy-, acetate Acetic acid (17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) ester Allopregn-16-enolone acetate EINECS 220-004-8
Wiley ID 1347384