Synthesis and conformational analysis of optically active ferrocene containing macrocyclic peptides

J Org Chem. 2002 Nov 1;67(22):7600-6. doi: 10.1021/jo020353b.

Abstract

Two macrocyclic peptides 3 and 4 were formed during lactamization of 1,1'-ferrocenylbis(alanine) 1. Isolation, structure determination, and conformational analysis of 3 and 4 are reported as well as a controlled stepwise synthesis of 4 also including an improved route to 1. On the basis of their (1)H NMR spectra recorded at 300 K in DMSO-d(6), the dimer 3 and trimer 4 were found to be C(2) and C(3) symmetric, respectively. As appeared from computational analysis, the low-energy conformations of the macrocyclic peptides were nonsymmetric. Cyclic voltammetry revealed that the ferrocenyl moieties in 3 or 4 are electrochemically equal to ferrocene.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Dimerization
  • Ferrous Compounds / chemical synthesis*
  • Ferrous Compounds / chemistry*
  • Magnetic Resonance Spectroscopy
  • Metallocenes
  • Models, Molecular
  • Molecular Conformation
  • Molecular Structure
  • Peptides / chemical synthesis*
  • Peptides / chemistry*
  • Stereoisomerism

Substances

  • Ferrous Compounds
  • Metallocenes
  • Peptides
  • ferrocene