| SpectraBase Compound ID | EQuvmubzAgM |
|---|---|
| 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/h7-8,16-18,21H,5-6,9-13H2,1-4H3/t16-,17-,18-,21-,22-,23+/m0/s1 |
| InChIKey | SZGDFEZFBKUSAS-VGSLKJDUSA-N |
| Mol Weight | 356.5 g/mol |
| Molecular Formula | C23H32O3 |
| Exact Mass | 356.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B1aqoFrdtpI |
|---|---|
| Name | 3.beta.-Acetoxy-5.alpha.-pregn-14,16-dien-20-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| 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/h7-8,16-18,21H,5-6,9-13H2,1-4H3/t16-,17-,18-,21-,22-,23+/m0/s1 |
| InChIKey | SZGDFEZFBKUSAS-VGSLKJDUSA-N |
| Molecular Weight | 356.506 g/mol |
| SMILES | [C@@]12(C([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])[H])=CC=C1C(=O)C)C |
| SPLASH | splash10-0006-9001000000-ee427d6a405c948a86d5 |
| Source of Spectrum | KC-0-271-10 |
| Synonyms | (3beta,5alpha)-20-oxopregna-14,16-dien-3-yl acetate Acetic acid[(3S,5S,8R,9S,10S,13S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12-decahydro-1H-cyclopenta[a]phenanthren-3-yl]ester [(3S,5S,8R,9S,10S,13S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12-decahydro-1H-cyclopenta[a]phenanthren-3-yl]acetate [(3S,5S,8R,9S,10S,13S)-17-ethanoyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12-decahydro-1H-cyclopenta[a]phenanthren-3-yl]ethanoate [(3S,5S,8R,9S,10S,13S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,5S,8R,9S,10S,13S)-17-ethanoyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 787316 |