SpectraBase Spectrum ID |
CTNlHciqMNH |
Name |
(10Z/E)-19-Fluoro-1.alpha.,25-dihydroxyvitamin D3 1,3-Di-tert-butyldiphenylsilyl Ether |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C59H79FO3Si2 |
InChI |
InChI=1S/C59H79FO3Si2/c1-44(25-23-39-58(8,9)61)53-37-38-54-45(26-24-40-59(53,54)10)35-36-46-41-47(62-64(56(2,3)4,48-27-15-11-16-28-48)49-29-17-12-18-30-49)42-55(52(46)43-60)63-65(57(5,6)7,50-31-19-13-20-32-50)51-33-21-14-22-34-51/h11-22,27-36,43-44,47,53-55,61H,23-26,37-42H2,1-10H3/b45-35+,46-36+,52-43-/t44-,47+,53-,54?,55-,59-/m1/s1 |
InChIKey |
YDGGIIZSFFQNSW-MQZPGOOPSA-N |
Molecular Weight |
911.446 g/mol |
SMILES |
OC(CCC[C@]([C@@]1([C@@]2(C(\C(=C\C=C\3\C([C@](O[Si](C(C)(C)C)(c4ccccc4)c4ccccc4)(C[C@@](O[Si](C(C)(C)C)(c4ccccc4)c4ccccc4)(C3)[H])[H])=C\F)CCC2)CC1)C)[H])(C)[H])(C)C |
SPLASH |
splash10-03g3-0000030096-361185dd905b2f594bcd |
Source of Spectrum |
E2-49-316-21 |
Synonyms |
(6R)-6-[(1R,4E,7aR)-4-{2-[(1E,2Z,3R,5S)-3,5-bis[(tert-butyldiphenylsilyl)oxy]-2-(fluoromethylidene)cyclohexylidene]ethylidene}-7a-methyl-octahydro-1H-inden-1-yl]-2-methylheptan-2-ol |
Wiley ID |
1555638 |