| SpectraBase Compound ID | A8bFNdsBEQI |
|---|---|
| InChI | InChI=1S/C28H49NO/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(29-30-6)14-16-27(21,4)26(23)15-17-28(24,25)5/h19-21,23-26H,7-18H2,1-6H3/b29-22+/t20-,21?,23+,24-,25+,26+,27+,28-/m1/s1 |
| InChIKey | CHNBWGCZJBZRBU-CAZYJVBASA-N |
| Mol Weight | 415.7 g/mol |
| Molecular Formula | C28H49NO |
| Exact Mass | 415.381415 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5iBOj0EuI8Z |
|---|---|
| Name | Cholestan-3-one, O-methyl oxime |
| CAS Registry Number | 55555-44-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H49NO |
| InChI | InChI=1S/C28H49NO/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(29-30-6)14-16-27(21,4)26(23)15-17-28(24,25)5/h19-21,23-26H,7-18H2,1-6H3/b29-22+/t20-,21?,23+,24-,25+,26+,27+,28-/m1/s1 |
| InChIKey | CHNBWGCZJBZRBU-CAZYJVBASA-N |
| Molecular Weight | 415.706 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(CCC4[C@@]([C@]3(CC2)[H])(CC\C(=N/OC)C4)C)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH | splash10-0i29-0951500000-8d84384d4531ef578390 |
| Source of Spectrum | T-67-4804-0 |
| Synonyms | 3-Methoxyimino-5-cholestane (E,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-N-methoxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-imine (E,8R,9S,10S,13R,14S,17R)-N-methoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-imine |
| Wiley ID | 1376109 |