W. Reischl et al., ON THE CONFORMATION AND CONFIGURATION OF THE CHOLECALCIFEROL-ISOXAZOLINE ADDUCTS, Liebigs Annalen der Chemie, (6), 1993, pp. 595-600
The conformation and configuration of compounds 1-4, generated by 1,3-
dipolar addition of nitrile oxides to the exomethylene group of (5Z)-
and (5E)-vitamin D3 has been assigned. A combination of force-field ca
lculations, LIS measurements, LIS simulations and CD spectroscopy has
been used. In addition, the assignment has been verified by chemical c
orrelation of 1 and 3 to 5 as well as of 2 and 4 to 6.