| SpectraBase Spectrum ID |
1Fa1vwKERU |
| Name |
3,16.alpha.-Bis[[(trifluoromethyl)sulfonyl]oxy]androst-3,5-dien-17-one |
| Alternate Name(s) |
(16alpha)-17-oxo-3-{[(trifluoromethyl)sulfonyl]oxy}androsta-3,5-dien-16-yl trifluoromethanesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24F6O7S2 |
| InChI |
InChI=1S/C21H24F6O7S2/c1-18-7-5-12(33-35(29,30)20(22,23)24)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(17(19)28)34-36(31,32)21(25,26)27/h3,9,13-16H,4-8,10H2,1-2H3/t13-,14+,15+,16-,18+,19+/m1/s1 |
| InChIKey |
LWKWYVOPHPRSCK-NBBHSKLNSA-N |
| Molecular Weight |
566.526 g/mol |
| SMILES |
C=1(CC[C@]2(C(C1)=CC[C@]1([C@@]3(C[C@](C([C@@]3(C)CC[C@]21[H])=O)(OS(=O)(=O)C(F)(F)F)[H])[H])[H])C)OS(=O)(=O)C(F)(F)F |
| SPLASH |
splash10-066r-9570060000-6f3067e63a69c6c95b19 |
| Source of Spectrum |
E1-35-2125-27 |
| Wiley ID |
1574359 |
![3,16.alpha.-Bis[[(trifluoromethyl)sulfonyl]oxy]androst-3,5-dien-17-one](/api/spectrum/1Fa1vwKERU/structure.png?h=300&w=458 "3,16.alpha.-Bis[[(trifluoromethyl)sulfonyl]oxy]androst-3,5-dien-17-one")
