| SpectraBase Compound ID | 950btKhnI9I |
|---|---|
| InChI | InChI=1S/C23H34O4/c1-14(24)23(26)12-9-20-18-6-5-16-13-17(27-15(2)25)7-10-21(16,3)19(18)8-11-22(20,23)4/h5,17-20,26H,6-13H2,1-4H3 |
| InChIKey | IQCNQJXIOWBNAT-UHFFFAOYSA-N |
| Mol Weight | 374.5 g/mol |
| Molecular Formula | C23H34O4 |
| Exact Mass | 374.24571 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Aztq7up0cIS |
|---|---|
| Name | Pregn-5-en-20-one, 3,17-dihydroxy-, 3-acetate |
| CAS Registry Number | 1863-39-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H34O4 |
| InChI | InChI=1S/C23H34O4/c1-14(24)23(26)12-9-20-18-6-5-16-13-17(27-15(2)25)7-10-21(16,3)19(18)8-11-22(20,23)4/h5,17-20,26H,6-13H2,1-4H3 |
| InChIKey | IQCNQJXIOWBNAT-UHFFFAOYSA-N |
| Molecular Weight | 374.521 g/mol |
| SMILES | OC1(C2(C)C(C3C(C4(C)C(CC(OC(C)=O)CC4)=CC3)CC2)CC1)C(C)=O |
| SPLASH | splash10-054n-5940000000-402ab890a5e9ce40a85e |
| Source of Spectrum | AA-0-2104-1 |
| Synonyms | Pregn-5-en-20-one, 3-(acetyloxy)-17-hydroxy-, (3.beta.)- 17-Hydroxy-20-oxopregn-5-en-3-yl acetate (17-acetyl-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl) acetate (17-ethanoyl-10,13-dimethyl-17-oxidanyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl) ethanoate Acetic acid (17-acetyl-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl) ester Pregn-5-en-20-one, 3.beta.,17-dihydroxy-, 3-acetate EINECS 217-467-3 SKF 2814 |
| Wiley ID | 54829 |