| SpectraBase Spectrum ID |
2X1npVDoQPK |
| Name |
Cholestane-3,11-dione, (5.alpha.,8.alpha.,9.beta.,14.beta.)- |
| CAS Registry Number |
69483-51-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H44O2 |
| InChI |
InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)13-14-26(19,4)25(21)24(29)16-27(22,23)5/h17-19,21-23,25H,6-16H2,1-5H3/t18-,19+,21-,22-,23-,25+,26+,27-/m1/s1 |
| InChIKey |
MCEHNLSYTUWKAL-VEJCOXHBSA-N |
| Molecular Weight |
400.647 g/mol |
| SMILES |
[C@@]12([C@@]([C@]3(CC[C@@]4([C@@]([C@@]3(C(C2)=O)[H])(CCC(=O)C4)C)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-01c4-9710000000-3daada4d5bd94ed3f8d5 |
| Source of Spectrum |
O-15-43-2 |
| Synonyms |
(5alpha,8alpha,9beta,14beta)-cholestane-3,11-dione
5.alpha.,8.alpha.,9.beta.,14.beta.-cholestane-3,11-dione |
| Wiley ID |
1369701 |
