| SpectraBase Spectrum ID |
K5Opjtlxf5o |
| Name |
4,5-epoxy-4alpha,5alpha-cholestan-3beta-ol acetate |
| Alternate Name(s) |
(1aR,2S,4aR,4bS,6aR,7R,9aS,9bS,11aS)-4a,6a-dimethyl-7-((R)-6-methylheptan-2-yl)hexadecahydrocyclopenta[7,8]phenanthro[1,10a-b]oxiren-2-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48O3 |
| InChI |
InChI=1S/C29H48O3/c1-18(2)8-7-9-19(3)22-10-11-23-21-12-17-29-26(32-29)25(31-20(4)30)14-16-28(29,6)24(21)13-15-27(22,23)5/h18-19,21-26H,7-17H2,1-6H3/t19-,21+,22-,23+,24+,25+,26-,27-,28-,29-/m1/s1 |
| InChIKey |
HXKDHGZOPCTTAY-QUSHEWTOSA-N |
| Literature Reference DOI |
10.1002/rcm.1433 |
| Molecular Weight |
444.700 g/mol |
| SMILES |
[C@@]12([H])O[C@]22CC[C@@]3([H])[C@]4([H])CC[C@]([H])([C@@](CCCC(C)C)(C)[H])[C@@]4(C)CC[C@]3([H])[C@@]2(C)CC[C@@]1(OC(C)=O)[H] |
| SPLASH |
splash10-001i-9815000000-6cecb501c2a8e114a969 |
| Source of Spectrum |
RCM-18-958-Fig2(A) |
| Wiley ID |
1820126 |
