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1-ALPHA-HYDROXY-CHOLECALCIFEROL;VITAMIN-D-DERIVATIVE
SpectraBase Compound ID 8Y5z21sR7W4
InChI InChI=1S/C27H44O2/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/h11-12,18-19,23-26,28-29H,4,6-10,13-17H2,1-3,5H3/b21-11+,22-12-/t19-,23-,24-,25+,26+,27-/m1/s1
InChIKey OFHCOWSQAMBJIW-AVJTYSNKSA-N
Mol Weight 400.6 g/mol
Molecular Formula C27H44O2
Exact Mass 400.334131 g/mol
Enantiomer InChIKey OFHCOWSQAMBJIW-BECVCULNSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • 1-ALPHA-HYDROXYVITAMIN-D(3)
Title Journal or Book Year
Pd-Catalyzed Carbocyclization−Negishi Cross-Coupling Cascade:  A Novel Approach to 1α,25-Dihydroxyvitamin D3 and Analogues Organic Letters 2005
Natural Abundance13C-NMR. of Vitamin D3Metabolites Helvetica Chimica Acta 1980

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