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[7,9,19-(13)C(3)]-(3R,5R,8R)-3,5-DEHYDRO-8-HYDROXY-9,10-SECO-25-(TRIMETHYLSILYLOXY)-CHOLEST-10(19)-EN-6-YNE

Compound with spectra: 1 NMR

[7,9,19-(13)C(3)]-(3R,5R,8R)-3,5-DEHYDRO-8-HYDROXY-9,10-SECO-25-(TRIMETHYLSILYLOXY)-CHOLEST-10(19)-EN-6-YNE
SpectraBase Compound ID 1mOIUgSpOIV
InChI InChI=1S/C30H50O2Si/c1-22(11-9-16-27(3,4)32-33(6,7)8)25-14-15-26-28(25,5)17-10-18-30(26,31)20-19-29-21-24(29)13-12-23(29)2/h22,24-26,31H,2,9-18,21H2,1,3-8H3/t22-,24-,25-,26-,28-,29-,30-/m1/s1/i2+1,18+1,20+1
InChIKey BJRDRTHWKOJMRM-PTBRAJNCSA-N
Mol Weight 473.8 g/mol
Molecular Formula C2713C3H50O2Si
Exact Mass 473.368072 g/mol
Enantiomer InChIKey BJRDRTHWKOJMRM-SGNDICSMSA-N

View Spectrum of [7,9,19-(13)C(3)]-(3R,5R,8R)-3,5-DEHYDRO-8-HYDROXY-9,10-SECO-25-(TRIMETHYLSILYLOXY)-CHOLEST-10(19)-EN-6-YNE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
[1R-[1.alpha.(R*),3a.beta.,4.alpha.(1R*,5R*),7a.alpha.]]-1-[(1,5-Dimethyl-5-[(trimethylsilyl)oxy]hexyl]octahydro-7a-methyl-4-[2-[(2-methylenebicycvlo[3.1.0]hexan-1-yl)ethynyl]-1H-inden-4-ol
[7,9,19-(13)C(3)]-(3R,5R,8R)-3,5-DEHYDRO-8-HYDROXY-9,10-SECOCHOLEST-10(19)-EN-6-YNE
[7,9,19-(13)C(3)]-(3R,5R)-(6E)-3,5-DEHYDRO-9,10-SECOCHOLESTA-6,10(19)-DIEN-8-BETA-OL
[9,19-(13)C(2)]-(3R,5R)-(6E)-3,5-DEHYDRO-9,10-SECOCHOLESTA-6,10(19)-DIEN-8-BETA-OL
ENT-16-BETA-H,17-METHYLBUTANOATE-KAURAN-19-OIC-ACID
5.BETA.-ANDROSTANE-3.BETA.,6.BETA.-DIOL-DI-TRIMETHYLSILYL ETHER
5.BETA.-ANDROSTANE-3.ALPHA.,6.BETA.-DIOL-DI-TRIMETHYLSILYL ETHER
5.ALPHA.-ANDROSTANE-3.BETA.,6.BETA.-DIOL-DI-TRIMETHYLSILYL ETHER
3.alpha.-Methylcholest-5-ene
Cholestan-3-ol, 3-(1,3-butadienyl)-, (3.alpha.,5.alpha.)-
B-Nor-5,6-secocholestan-6-oic acid, 1-oxo-, (10.beta.)-
Title Journal or Book Year
Synthesis and NMR Studies of 13C-Labeled Vitamin D Metabolites1 The Journal of Organic Chemistry 2002
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