| SpectraBase Compound ID | 9ypI3kJYPmm |
|---|---|
| InChI | InChI=1S/C29H46O3/c1-18(2)27(31)12-7-19(3)24-10-11-25-23-9-8-21-17-22(32-20(4)30)13-15-28(21,5)26(23)14-16-29(24,25)6/h8,18-19,22-26H,7,9-17H2,1-6H3 |
| InChIKey | XLVMMFHWIROLGG-UHFFFAOYSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C29H46O3 |
| Exact Mass | 442.344695 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GYdrVxrveTa |
|---|---|
| Name | Cholest-5-en-24-one, 3-(acetyloxy)-, (3.beta.)- |
| CAS Registry Number | 20981-59-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H46O3 |
| InChI | InChI=1S/C29H46O3/c1-18(2)27(31)12-7-19(3)24-10-11-25-23-9-8-21-17-22(32-20(4)30)13-15-28(21,5)26(23)14-16-29(24,25)6/h8,18-19,22-26H,7,9-17H2,1-6H3 |
| InChIKey | XLVMMFHWIROLGG-UHFFFAOYSA-N |
| Molecular Weight | 442.684 g/mol |
| SMILES | CC12C(C3C(CC2)C2(C)C(=CC3)CC(CC2)OC(C)=O)CCC1C(CCC(C(C)C)=O)C |
| SPLASH | splash10-001i-7924000000-111d84dc8987392f6a21 |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | Cholest-5-en-24-one, 3.beta.-hydroxy-, acetate 24-Oxocholest-5-en-3-yl acetate 24-Ketocholesteryl acetate 24-Oxocholesterol acetate Acetic acid [10,13-dimethyl-17-(6-methyl-5-oxoheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [10,13-dimethyl-17-(6-methyl-5-oxoheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-(1,5-dimethyl-4-oxo-hexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-(6-methyl-5-oxidanylidene-heptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 1385496 |