| SpectraBase Compound ID | JSmoYJ16t5u |
|---|---|
| InChI | InChI=1S/C27H48O3/c1-17(16-28)5-10-25(30)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h17-25,28-30H,5-16H2,1-4H3 |
| InChIKey | UIHBLSYNQQGXQT-UHFFFAOYSA-N |
| Mol Weight | 420.7 g/mol |
| Molecular Formula | C27H48O3 |
| Exact Mass | 420.360345 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FhoRr6vxmZK |
|---|---|
| Name | Cholestane-3,22,26-triol |
| Alternate Name(s) | Cholestan-3,22,26-triol 6-(3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptane-1,5-diol 6-(10,13-dimethyl-3-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methyl-heptane-1,5-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H48O3 |
| InChI | InChI=1S/C27H48O3/c1-17(16-28)5-10-25(30)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h17-25,28-30H,5-16H2,1-4H3 |
| InChIKey | UIHBLSYNQQGXQT-UHFFFAOYSA-N |
| Molecular Weight | 420.678 g/mol |
| SMILES | OCC(CCC(C(C1C2(CCC3C4(CCC(CC4CCC3C2CC1)O)C)C)C)O)C |
| SPLASH | splash10-0002-9410000000-560d46e009465554cf25 |
| Source of Spectrum | NP-14-8773-0 |
| Wiley ID | 1112066 |