| SpectraBase Compound ID | 7iPZEzKqwzu |
|---|---|
| InChI | InChI=1S/C24H40O2/c1-5-6-15(2)19-9-10-20-18-8-7-16-13-17(25)11-12-23(16,3)21(18)14-22(26)24(19,20)4/h15-21,25H,5-14H2,1-4H3 |
| InChIKey | WEOMSFOWTMNNOU-UHFFFAOYSA-N |
| Mol Weight | 360.6 g/mol |
| Molecular Formula | C24H40O2 |
| Exact Mass | 360.302831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GMzAQ1RI2HH |
|---|---|
| Name | Cholan-12-one, 3-hydroxy-, (3.alpha.,5.beta.)- |
| CAS Registry Number | 54411-58-4 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H40O2 |
| InChI | InChI=1S/C24H40O2/c1-5-6-15(2)19-9-10-20-18-8-7-16-13-17(25)11-12-23(16,3)21(18)14-22(26)24(19,20)4/h15-21,25H,5-14H2,1-4H3 |
| InChIKey | WEOMSFOWTMNNOU-UHFFFAOYSA-N |
| Molecular Weight | 360.582 g/mol |
| SMILES | OC1CC2C(C3C(C4C(C)(C(C(CCC)C)CC4)C(=O)C3)CC2)(C)CC1 |
| SPLASH | splash10-03di-9658000000-98604bd0cf63d2fe64fa |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | 3-Hydroxycholan-12-one 10,13-dimethyl-3-oxidanyl-17-pentan-2-yl-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-12-one 3-Hydroxy-10,13-dimethyl-17-(1-methylbutyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-12-one 3-Hydroxy-10,13-dimethyl-17-pentan-2-yl-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-12-one |
| Wiley ID | 1348703 |