| SpectraBase Compound ID | E9CmXRY1uEw |
|---|---|
| InChI | InChI=1S/C29H49NO2/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-26(30-20(4)31)27(32)17-29(21,6)25(22)14-15-28(23,24)5/h18-19,21-26H,7-17H2,1-6H3,(H,30,31)/t19-,21+,22?,23-,24?,25?,26-,28-,29+/m1/s1 |
| InChIKey | XTZIJAXFDWSOKZ-XWQRCTMTSA-N |
| Mol Weight | 443.7 g/mol |
| Molecular Formula | C29H49NO2 |
| Exact Mass | 443.37633 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 415CSeHh1sm |
|---|---|
| Name | 3.beta.-(Acetylamino)-5.alpha.-cholestan-2-one |
| Alternate Name(s) | 3.beta.-(Acetylamino0-5.alpha.-cholestan-2-one N-[(3beta,5alpha)-2-oxocholestan-3-yl]acetamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H49NO2 |
| InChI | InChI=1S/C29H49NO2/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-26(30-20(4)31)27(32)17-29(21,6)25(22)14-15-28(23,24)5/h18-19,21-26H,7-17H2,1-6H3,(H,30,31)/t19-,21+,22?,23-,24?,25?,26-,28-,29+/m1/s1 |
| InChIKey | XTZIJAXFDWSOKZ-XWQRCTMTSA-N |
| Molecular Weight | 443.716 g/mol |
| SMILES | N([C@@]1(C[C@]2([C@@](C3C(C4CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])CC2)(CC1=O)C)[H])[H])C(=O)C |
| SPLASH | splash10-002f-0002900000-18a5945b84cb96a1b624 |
| Source of Spectrum | G-63-1594-8 |
| Wiley ID | 749325 |