SpectraBase Spectrum ID |
LH0fTMKig5t |
Name |
6,7-Dehydro-1.alpha.-hydroxyprevitamin D3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H42O2 |
InChI |
InChI=1S/C27H42O2/c1-18(2)8-6-9-19(3)24-13-14-25-21(10-7-15-27(24,25)5)11-12-22-16-23(28)17-26(29)20(22)4/h10,18-19,23-26,28-29H,6-9,13-17H2,1-5H3/t19-,23+,24-,25+,26-,27-/m1/s1 |
InChIKey |
VRPVXFCJLKPQFY-OEEKBWFQSA-N |
Molecular Weight |
398.631 g/mol |
SMILES |
O[C@@]1(C[C@](CC(=C1C)C#CC=1[C@]2([C@@]([C@](CC2)([C@@](CCCC(C)C)(C)[H])[H])(CCC1)C)[H])(O)[H])[H] |
SPLASH |
splash10-004i-0009000000-61a4203c4f1626a17ba7 |
Source of Spectrum |
F-47-3495-2 |
Synonyms |
(1R,3S)-9,10-secocholesta-5(10),8-dien-6-yne-1,3-diol
6,7-Dehydro-1.alpha.-hydroxyprevltamin D3 |
Wiley ID |
1368708 |