✦ LIBER ✦

Conformational study of fosinopril sodium in solution using NMR and molecular modeling

✍ Scribed by Songbai Liu; Yanhong Shi; Qingwen Zhang; Guoqiang Song

Publisher: John Wiley and Sons
Year: 2003
Tongue: English
Weight: 133 KB
Volume: 41
Category: Article
ISSN: 0749-1581
DOI: 10.1002/mrc.1230

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✦ Synopsis

Abstract

Two conformers of fosinopril sodium in methanol were unambiguously established using 2D NMR methods and variable‐temperature NMR experiments. Differences in their conformational structure were shown to be related to the rotational energy barrier about the amide bond and hydrophobic interaction. The relationship between the 3D structure and activity is discussed. It is suggested that the trans‐conformer may be more biologically active owing to its stacking structure and strong hydrophobic interaction and the cis‐conformer could be more easily hydrolyzed because of its extended structure. Copyright © 2003 John Wiley & Sons, Ltd.

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