| SpectraBase Compound ID | 1y0JqkxygpS |
|---|---|
| InChI | InChI=1S/C29H50O3/c1-19(2)7-6-8-20(3)25-13-14-26-24-12-10-22-9-11-23(32-21(4)31)17-29(22,18-30)27(24)15-16-28(25,26)5/h19-20,22-27,30H,6-18H2,1-5H3 |
| InChIKey | QCHLNDJQZZDVLC-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 | DpEt9hz1Xjo |
|---|---|
| Name | 5.alpha.-Cholestane-2.alpha.,19-diol, 2-acetate |
| CAS Registry Number | 28809-69-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H50O3 |
| InChI | InChI=1S/C29H50O3/c1-19(2)7-6-8-20(3)25-13-14-26-24-12-10-22-9-11-23(32-21(4)31)17-29(22,18-30)27(24)15-16-28(25,26)5/h19-20,22-27,30H,6-18H2,1-5H3 |
| InChIKey | QCHLNDJQZZDVLC-UHFFFAOYSA-N |
| Molecular Weight | 446.716 g/mol |
| SMILES | OCC12C3C(C4C(CC3)(C)C(C(CCCC(C)C)C)CC4)CCC2CCC(C1)OC(C)=O |
| SPLASH | splash10-0079-0019100000-768f59129e83982bfc16 |
| Source of Spectrum | O-4-374-1 |
| Synonyms | 19-Hydroxycholestan-2-yl acetate Acetic acid [10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl] ester [10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl] acetate [17-(1,5-dimethylhexyl)-10-(hydroxymethyl)-13-methyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl] acetate [10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl] ethanoate |
| Wiley ID | 1386813 |