| SpectraBase Spectrum ID |
2NnPd7NFTyQ |
| Name |
5.alpha.-Cholestan-19-ol, 2.alpha.-chloro-, acetate |
| CAS Registry Number |
28809-78-1 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H49ClO2 |
| InChI |
InChI=1S/C29H49ClO2/c1-19(2)7-6-8-20(3)25-13-14-26-24-12-10-22-9-11-23(30)17-29(22,18-32-21(4)31)27(24)15-16-28(25,26)5/h19-20,22-27H,6-18H2,1-5H3/t20-,22-,23+,24+,25-,26+,27+,28-,29-/m1/s1 |
| InChIKey |
BZDRKKXNVIMWQO-FJRKYHHQSA-N |
| Molecular Weight |
465.162 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@]2(CC[C@@](C1)(Cl)[H])[H])[H])COC(=O)C |
| SPLASH |
splash10-0hfx-0006900000-4310fe250fdca5cc7bdf |
| Source of Spectrum |
O-4-3779-0 |
| Synonyms |
(2alpha,5alpha)-2-chlorocholestan-19-yl acetate
2.alpha.-chloro-19-acetoxymethyl-5.alpha.-cholestane |
| Wiley ID |
1391613 |
