| SpectraBase Compound ID | 75ajILqTMdc |
|---|---|
| InChI | InChI=1S/C31H52ClNO/c1-21(2)8-6-9-22(3)26-13-14-27-25-12-11-23-20-24(33-29(34)10-7-19-32)15-17-30(23,4)28(25)16-18-31(26,27)5/h11,21-22,24-28H,6-10,12-20H2,1-5H3,(H,33,34)/t22-,24+,25?,26-,27?,28?,30+,31-/m1/s1 |
| InChIKey | MFEKHRAFTOAMJX-PHZPAERESA-N |
| Mol Weight | 490.2 g/mol |
| Molecular Formula | C31H52ClNO |
| Exact Mass | 489.373743 g/mol |
| SpectraBase Spectrum ID | 2xsPbS6Utex |
|---|---|
| Name | Butanamide, 4-chloro-N-[(3.beta.)-cholest-5-en-3-yl]- |
| CAS Registry Number | 38759-54-5 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H52ClNO |
| InChI | InChI=1S/C31H52ClNO/c1-21(2)8-6-9-22(3)26-13-14-27-25-12-11-23-20-24(33-29(34)10-7-19-32)15-17-30(23,4)28(25)16-18-31(26,27)5/h11,21-22,24-28H,6-10,12-20H2,1-5H3,(H,33,34)/t22-,24+,25?,26-,27?,28?,30+,31-/m1/s1 |
| InChIKey | MFEKHRAFTOAMJX-PHZPAERESA-N |
| Molecular Weight | 490.216 g/mol |
| SMILES | N(C(=O)CCCCl)[C@]1(CC[C@@]2(C3CC[C@]4(C(C3CC=C2C1)CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])C)C)[H] |
| SPLASH | splash10-000i-9301600000-4207d78d30c22aceb141 |
| Source of Spectrum | EP-6903-0-0 |
| Synonyms | 3.beta.-(4'chloro)butyramidocholest-5-ene 4-Chloro-N-[(3beta)-cholest-5-en-3-yl]butanamide |
| Wiley ID | 1397100 |