| SpectraBase Compound ID | GixPNbyFdJK |
|---|---|
| InChI | InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)13-14-26(19,4)25(21)24(29)16-27(22,23)5/h17-25,28-29H,6-16H2,1-5H3 |
| InChIKey | YHDOHJOIKRNFGT-UHFFFAOYSA-N |
| Mol Weight | 404.7 g/mol |
| Molecular Formula | C27H48O2 |
| Exact Mass | 404.365431 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8nJktW5o1Wo |
|---|---|
| Name | Cholestane-3,11-diol |
| Alternate Name(s) | 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]phenanthrene-3,11-diol 17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,11-diol 5.alpha.,14.beta.-Cholestane-3.beta.,11.alpha.-diol 5.alpha.,8.alpha.,14.beta.-Cholestane-3.beta.,11.beta.-diol |
| CAS Registry Number | 69454-64-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H48O2 |
| InChI | InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)13-14-26(19,4)25(21)24(29)16-27(22,23)5/h17-25,28-29H,6-16H2,1-5H3 |
| InChIKey | YHDOHJOIKRNFGT-UHFFFAOYSA-N |
| Molecular Weight | 404.679 g/mol |
| SMILES | OC1C2C(CCC3C2(CCC(C3)O)C)C2C(C1)(C(CC2)C(CCCC(C)C)C)C |
| SPLASH | splash10-00du-0479000000-0e38dd5027cd089e7f20 |
| Source of Spectrum | J-44-1869-0 |
| Wiley ID | 1371582 |