| SpectraBase Compound ID | 8joHDcg1mxF |
|---|---|
| InChI | InChI=1S/C29H50O3/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-27(32-20(4)30)26(31)17-29(21,6)25(22)14-15-28(23,24)5/h18-19,21-27,31H,7-17H2,1-6H3 |
| InChIKey | HFJDAIVNDINPBV-UHFFFAOYSA-N |
| Mol Weight | 446.7 g/mol |
| Molecular Formula | C29H50O3 |
| Exact Mass | 446.375995 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3jYimlx2rA |
|---|---|
| Name | Cholestane-2,3-diol, 3-acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H50O3 |
| InChI | InChI=1S/C29H50O3/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-27(32-20(4)30)26(31)17-29(21,6)25(22)14-15-28(23,24)5/h18-19,21-27,31H,7-17H2,1-6H3 |
| InChIKey | HFJDAIVNDINPBV-UHFFFAOYSA-N |
| Molecular Weight | 446.716 g/mol |
| SMILES | OC1CC2(C3C(C4C(C(C(C)CCCC(C)C)CC4)(CC3)C)CCC2CC1OC(=O)C)C |
| SPLASH | splash10-0a5l-9732000000-250515fdeeb6e2fcdf6a |
| Synonyms | 2-Hydroxycholestan-3-yl acetate Acetic acid [2-hydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [2-hydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-(1,5-dimethylhexyl)-2-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-(6-methylheptan-2-yl)-2-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 1474376 |