| SpectraBase Compound ID | 9kwGFhGXgPr |
|---|---|
| InChI | InChI=1S/C29H50O3/c1-19(2)8-7-9-20(3)24-10-11-25-23-13-17-29(31)18-22(32-21(4)30)12-16-28(29,6)26(23)14-15-27(24,25)5/h19-20,22-26,31H,7-18H2,1-6H3 |
| InChIKey | XGBHFLNWQIPOQW-UHFFFAOYSA-N |
| Mol Weight | 446.7 g/mol |
| Molecular Formula | C29H50O3 |
| Exact Mass | 446.375995 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B1DRJ9MWWvo |
|---|---|
| Name | 5-Hydroxycholestan-3-yl acetate |
| CAS Registry Number | 1256-33-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H50O3 |
| InChI | InChI=1S/C29H50O3/c1-19(2)8-7-9-20(3)24-10-11-25-23-13-17-29(31)18-22(32-21(4)30)12-16-28(29,6)26(23)14-15-27(24,25)5/h19-20,22-26,31H,7-18H2,1-6H3 |
| InChIKey | XGBHFLNWQIPOQW-UHFFFAOYSA-N |
| Molecular Weight | 446.716 g/mol |
| SMILES | OC12CC(CCC2(C)C2C(C3CCC(C(C)CCCC(C)C)C3(C)CC2)CC1)OC(=O)C |
| SPLASH | splash10-02w9-9866200000-53cfe0842a1f6dc17c1f |
| Source of Spectrum | OS-6-215-0 |
| Synonyms | 3.beta.-Acetoxy-5.alpha.-hydroxycholestane Acetic acid [5-hydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] ester [5-hydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate [17-(1,5-dimethylhexyl)-5-hydroxy-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-(6-methylheptan-2-yl)-5-oxidanyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 1386816 |