SpectraBase Spectrum ID |
9uHCVFjJE9Y |
Name |
Des-A,B-23,24-dinor-22-(tosyloxy)cholane-8.beta.-ol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H30O4S |
InChI |
InChI=1S/C20H30O4S/c1-14-6-8-16(9-7-14)25(22,23)24-13-15(2)17-10-11-18-19(21)5-4-12-20(17,18)3/h6-9,15,17-19,21H,4-5,10-13H2,1-3H3/t15-,17-,18+,19+,20-/m1/s1 |
InChIKey |
CZKSQENRQZPNOS-LFZDHENXSA-N |
Ionization Type |
EI |
Molecular Weight |
366.516 g/mol |
Optical Rotation |
[a]D = +21.0 (c = 1.10, CHCl3) |
SMILES |
O[C@]1(CCC[C@]2([C@]1(CC[C@@]2([C@@](COS(c1ccc(cc1)C)(=O)=O)(C)[H])[H])[H])C)[H] |
SPLASH |
splash10-03fr-0900000000-7ae8d75fab814534b926 |
Source of Spectrum |
EP1817278B1 |
Wiley ID |
1841719 |