| SpectraBase Compound ID | 5n7uY3VhXDZ |
|---|---|
| InChI | InChI=1S/C28H48O3/c1-17(2)28(6,31)14-9-18(3)21-7-8-22-20-16-25(30)24-15-19(29)10-12-27(24,5)23(20)11-13-26(21,22)4/h17-24,29,31H,7-16H2,1-6H3/t18-,19?,20+,21-,22+,23+,24-,26-,27-,28+/m1/s1 |
| InChIKey | DZLGUEFTMPSAKH-ZYVWMGCBSA-N |
| Mol Weight | 432.7 g/mol |
| Molecular Formula | C28H48O3 |
| Exact Mass | 432.360345 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HZ28ZWJ7Ag1 |
|---|---|
| Name | (24S)-3,24-Dihydroxy-24-methyl-5.alpha.-cholestan-6-one |
| Alternate Name(s) | (5alpha,24S)-3,24-dihydroxyergostan-6-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H48O3 |
| InChI | InChI=1S/C28H48O3/c1-17(2)28(6,31)14-9-18(3)21-7-8-22-20-16-25(30)24-15-19(29)10-12-27(24,5)23(20)11-13-26(21,22)4/h17-24,29,31H,7-16H2,1-6H3/t18-,19?,20+,21-,22+,23+,24-,26-,27-,28+/m1/s1 |
| InChIKey | DZLGUEFTMPSAKH-ZYVWMGCBSA-N |
| Molecular Weight | 432.689 g/mol |
| SMILES | O[C@@](CC[C@]([C@]1(CC[C@]2([C@]3([C@@]([C@]4(CCC(C[C@@]4(C(C3)=O)[H])O)C)(CC[C@]12C)[H])[H])[H])[H])(C)[H])(C(C)C)C |
| SPLASH | splash10-0079-0009200000-6cbcaa7ff38aaa67d5a0 |
| Source of Spectrum | F-53-17053-24 |
| Wiley ID | 804710 |