1. 5α,6α-Epoxy-7-norcholestan-3β-yl acetate
- Author
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L. C. R. Andrade, J. A. Paixão, M. J. M. de Almeida, J. F. S. Carvalho, and M. M. Cruz Silva
- Subjects
Crystallography ,QD901-999 - Abstract
The title cholestan, C28H46O3, was prepared by epoxidation of 7-norcholest-5-en-3β-yl acetate and crystallized by slow evaporation from an ethanolic solution. All rings are trans fused. The 3β-acetate and the 17β-cholestane side chain are in equatorial positions. The molecule is highly twisted due to its B-nor characteristic. A quantum chemical ab-initio Roothaan Hartree–Fock calculation of the equilibrium geometry of the isolated molecule gives values for bond lengths and valency angles in close agreement with the experimental ones.
- Published
- 2012
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