| SpectraBase Spectrum ID |
7JiRAHyZIRB |
| Name |
19-norcholestan-3-one |
| Alternate Name(s) |
(17beta)-17-[(1R)-1,5-dimethylhexyl]estran-3-one |
| CAS Registry Number |
130855-70-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H44O |
| InChI |
InChI=1S/C26H44O/c1-17(2)6-5-7-18(3)24-12-13-25-23-10-8-19-16-20(27)9-11-21(19)22(23)14-15-26(24,25)4/h17-19,21-25H,5-16H2,1-4H3/t18-,19?,21+,22-,23-,24-,25+,26-/m1/s1 |
| InChIKey |
MNVHJLHYIJWMCX-ANALUZCGSA-N |
| Molecular Weight |
372.637 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CCC4[C@@]([C@]3(CC2)[H])(CCC(=O)C4)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-01b9-0698000000-6fe157b10fa47e97fb2c |
| Source of Spectrum |
KC-1990-2203-28 |
| Wiley ID |
1355911 |
