| SpectraBase Compound ID | 2NZtChjPaiD |
|---|---|
| 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/h8,16-19,21H,5-7,9-13H2,1-4H3/t16-,17-,18-,19+,21-,22-,23+/m0/s1 |
| InChIKey | JUAATDNYHZEPLN-ZAZLRJHESA-N |
| Mol Weight | 358.5 g/mol |
| Molecular Formula | C23H34O3 |
| Exact Mass | 358.250795 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3ttpwtpSq9v |
|---|---|
| Name | 3.beta.-Acetoxy-5.alpha.-pregn-14-en-20-one |
| 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/h8,16-19,21H,5-7,9-13H2,1-4H3/t16-,17-,18-,19+,21-,22-,23+/m0/s1 |
| InChIKey | JUAATDNYHZEPLN-ZAZLRJHESA-N |
| Molecular Weight | 358.522 g/mol |
| SMILES | C1=2[C@@]([C@@](C(=O)C)(CC2)[H])(CC[C@@]2([C@]3(CC[C@](OC(=O)C)(C[C@@]3(CC[C@@]12[H])[H])[H])C)[H])C |
| SPLASH | splash10-08fu-3924000000-f01d21f37470f64bdc0a |
| Source of Spectrum | KC-0-271-6 |
| Synonyms | (3beta,5alpha)-20-oxopregn-14-en-3-yl acetate [(3S,5S,8R,9S,10S,13R,17S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,5S,8R,9S,10S,13R,17S)-17-ethanoyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 787212 |