| SpectraBase Spectrum ID |
3GLpBiAbkGa |
| Name |
(5E,7E)-(1S,3R,20R,24S)-20-Fluoro-26,27-cyclo-9,10-secocholesta-5,7,10(19)-trien-1,3,24-triol |
| Alternate Name(s) |
(1S,3R,5E,7E,20R,24S)-24-cyclopropyl-20-fluoro-9,10-secochola-5,7,10-triene-1,3,24-triol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H41FO3 |
| InChI |
InChI=1S/C27H41FO3/c1-17-20(15-21(29)16-24(17)31)9-6-18-5-4-13-26(2)22(18)10-11-25(26)27(3,28)14-12-23(30)19-7-8-19/h6,9,19,21-25,29-31H,1,4-5,7-8,10-16H2,2-3H3/b18-6+,20-9+/t21-,22+,23+,24+,25+,26+,27-/m1/s1 |
| InChIKey |
HWJFYSSICSOIHQ-AUEOFRDXSA-N |
| Molecular Weight |
432.620 g/mol |
| SMILES |
O[C@]1(C[C@@](C\C(C1=C)=C\C=C\1[C@]2([C@@]([C@@]([C@@](CC[C@@](C3CC3)(O)[H])(F)C)(CC2)[H])(CCC1)C)[H])(O)[H])[H] |
| SPLASH |
splash10-001i-0902200000-31dbae6a42c343600725 |
| Source of Spectrum |
F-51-9549-19 |
| Wiley ID |
793228 |
