| SpectraBase Compound ID | JxbtuLWfZxL |
|---|---|
| InChI | InChI=1S/C23H34O4/c1-13(24)17-5-6-18-21-19(8-10-23(17,18)4)22(3)9-7-16(27-14(2)25)11-15(22)12-20(21)26/h12-13,16-19,21,24H,5-11H2,1-4H3/t13?,16-,17+,18?,19?,21?,22-,23+/m0/s1 |
| InChIKey | UJCCYDWUJONTJE-QCEBDYDNSA-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 | Kc1mbpnNXeb |
|---|---|
| Name | 7-Oxo-20-hydroxypregn-5-en-3.beta.-yl acetate |
| Alternate Name(s) | (3beta)-20-hydroxy-7-oxopregn-5-en-3-yl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H34O4 |
| InChI | InChI=1S/C23H34O4/c1-13(24)17-5-6-18-21-19(8-10-23(17,18)4)22(3)9-7-16(27-14(2)25)11-15(22)12-20(21)26/h12-13,16-19,21,24H,5-11H2,1-4H3/t13?,16-,17+,18?,19?,21?,22-,23+/m0/s1 |
| InChIKey | UJCCYDWUJONTJE-QCEBDYDNSA-N |
| Molecular Weight | 374.521 g/mol |
| SMILES | OC([C@@]1([C@@]2(C(C3C(C=C4[C@@](C3CC2)(CC[C@](OC(=O)C)(C4)[H])C)=O)CC1)C)[H])C |
| SPLASH | splash10-03di-0519000000-d501b00066abbc408224 |
| Source of Spectrum | G-61-410-10 |
| Wiley ID | 749010 |