| SpectraBase Spectrum ID |
6pS4I9gb6T8 |
| Name |
(20R,22E)-Des-A,B-25-carbobutylsulfanyl-24-oxo-8.beta.-[(triethylsilyl)oxy]-26,27-cyclo-22-dehydrocholestane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H50O3SSi |
| InChI |
InChI=1S/C29H50O3SSi/c1-7-11-21-33-27(31)29(19-20-29)26(30)17-14-22(5)23-15-16-24-25(13-12-18-28(23,24)6)32-34(8-2,9-3)10-4/h14,17,22-25H,7-13,15-16,18-21H2,1-6H3/b17-14+/t22-,23-,24+,25+,28-/m1/s1 |
| InChIKey |
DYPRXCPSXUPQBW-PPARJDBUSA-N |
| Ionization Type |
EI |
| Molecular Weight |
506.861 g/mol |
| Optical Rotation |
[a]D = +32.8 (c = 1.05, CHCl3) |
| SMILES |
C1C[C@]2([C@]([C@](C1)(O[Si](CC)(CC)CC)[H])(CC[C@@]2([C@](C)(\C=C\C(C1(C(SCCCC)=O)CC1)=O)[H])[H])[H])C |
| SPLASH |
splash10-0aor-0920000000-adf9b920dde55f07b6fc |
| Source of Spectrum |
EP2714656A2 |
| Wiley ID |
1849827 |
![(20R,22E)-Des-A,B-25-carbobutylsulfanyl-24-oxo-8.beta.-[(triethylsilyl)oxy]-26,27-cyclo-22-dehydrocholestane](/api/spectrum/6pS4I9gb6T8/structure.png?h=300&w=458 "(20R,22E)-Des-A,B-25-carbobutylsulfanyl-24-oxo-8.beta.-[(triethylsilyl)oxy]-26,27-cyclo-22-dehydrocholestane")
