| SpectraBase Spectrum ID |
Fy6K4fKtOPX |
| Name |
Des-A,B-25-hydroxy-18,21-dinorcholestane-8-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H28O2 |
| InChI |
InChI=1S/C16H28O2/c1-16(2,18)11-4-3-6-12-9-10-14-13(12)7-5-8-15(14)17/h12-14,18H,3-11H2,1-2H3/t12-,13+,14+/m0/s1 |
| InChIKey |
MBOFTAMFEAJRRZ-BFHYXJOUSA-N |
| Ionization Type |
EI |
| Molecular Weight |
252.398 g/mol |
| Optical Rotation |
[a]D = +9.0 (c = 0.95, CHCl3) |
| SMILES |
OC(CCCC[C@@]1([C@@]2([C@@]([H])(CC1)C(CCC2)=O)[H])[H])(C)C |
| SPLASH |
splash10-014i-5390000000-2a9fdbd4242b3df1035c |
| Source of Spectrum |
US7704981B2 |
| Wiley ID |
1842562 |
