MOLECULAR STRUCTURES OF SOME D-HOMO-6-OXA-8α ANALOGS OF STEROIDAL ESTROGENS

Authors

  • А. Г. Шавва Chemical Faculty, St. Petersburg State University, St. Petersburg, Petrodvorets 198504
  • Г. Л. Старова Chemical Faculty, St. Petersburg State University, St. Petersburg, Petrodvorets 198504
  • С. И. Селиванов Chemical Faculty, St. Petersburg State University, St. Petersburg, Petrodvorets 198504
  • С. Н. Морозкина Chemical Faculty, St. Petersburg State University, St. Petersburg, Petrodvorets 198504

DOI:

https://doi.org/10.1007/6962

Keywords:

steroidal estrogen analogs, molecular structure, molecular modeling

Abstract

By X-ray crystallographic analysis and NMR spectroscopy it was demonstrated that the conformations of several D-homo-6-oxa-8α  analogs  of  steroidal estrogens are similar in the crystal and in solution. The distances between the hydrogen atoms in these  molecules,  calculated  by the ab initio and MM+ methods, correspond to the experimental data.

How to Cite
Shavva, A. G.; Starova, G. L.; Selivanov, S. I.; Morozkina, S. N.  Chem. Heterocycl. Compd. 2008, 44, 148. [Khim. Geterotsikl. Soedin. 2008, 202.]

For this article in the English edition see DOI 10.1007/s10593-008-0036-2


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Published

2022-08-08

Issue

No. 2 (2008)

Section

Original Papers