SpectraBase Spectrum ID |
KnYoR1681Y8 |
Name |
(5Z,7E,10E)-19-Fluoro-9,10-seco-5,7,10(19)-cholestriene-3-ol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H43FO |
InChI |
InChI=1S/C27H43FO/c1-19(2)7-5-8-20(3)25-14-15-26-21(9-6-16-27(25,26)4)10-11-22-17-24(29)13-12-23(22)18-28/h10,17-20,24-26,29H,5-9,11-16H2,1-4H3/b21-10+,23-18-/t20-,24+,25?,26?,27-/m1/s1 |
InChIKey |
DHPRMHCBVMXLBU-HSCUHNSMSA-N |
Molecular Weight |
402.638 g/mol |
SMILES |
O[C@@]1(C=C(C\C=C\2C3[C@@](C(CC3)[C@@](CCCC(C)C)(C)[H])(CCC2)C)\C(=C/F)CC1)[H] |
SPLASH |
splash10-0f79-0922200000-1c11bd2dc2243615bb20 |
Source of Spectrum |
E2-48-1491-2 |
Wiley ID |
1555347 |