| SpectraBase Spectrum ID |
4lFo5K7vlrg |
| Name |
Cholest-4-en-3-one, 2-(acetyloxy)-, (2.alpha.)- |
| Alternate Name(s) |
(2beta)-3-oxocholest-4-en-2-yl acetate
2.beta.-acetoxycholest-4-en-3-one
Cholest-4-en-3-one, 2.alpha.-hydroxy-, acetate |
| CAS Registry Number |
2066-08-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H46O3 |
| InChI |
InChI=1S/C29H46O3/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-26(31)27(32-20(4)30)17-29(21,6)25(22)14-15-28(23,24)5/h16,18-19,22-25,27H,7-15,17H2,1-6H3/t19-,22+,23-,24+,25+,27+,28-,29+/m1/s1 |
| InChIKey |
HXUGNDVVHVLCAY-OBMFXHJKSA-N |
| Molecular Weight |
442.684 g/mol |
| SMILES |
[C@@]12(C(=CC([C@](C2)(OC(=O)C)[H])=O)CC[C@]2([C@@]3(CC[C@@]([C@]3(CC[C@]12[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])C |
| SPLASH |
splash10-00e9-0709100000-93d9b8a255f0edf36aef |
| Source of Spectrum |
J-43-1601-0 |
| Wiley ID |
1385518 |
