Aspartame analogues containing 1-amino-2-phenylcyclohexanecarboxylic acids (c6Phe)

This report describes the synthesis and the conformational analysis of the optically pure dipeptides analogues of aspartame: H-(S)-Asp-(1R,2R)-c6Phe-OMe and H-(S)-Asp-(1S,2S)-c6Phe-OMe, in which the Phe residue of aspartame has been replaced by a restricted Phe with a cyclohexane skeleton: 1-amino-2...

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Detalles Bibliográficos
Autores: Avenoza, A. [0000-0002-5465-3555], París, M., Peregrina, J.M. [0000-0003-3778-7065], Alías, M., López, M.P. [0000-0001-8105-2432], García, J.I. [0000-0003-1199-2087], Cativiela, C.
Tipo de recurso: artículo
Estado:Versión publicada
Fecha de publicación:2002
País:España
Institución:Universidad de La Rioja (UR)
Repositorio:RIUR. Repositorio Institucional de la Universidad de La Rioja
OAI Identifier:oai:portal.dialnet.es:doc/5bbc6908b750603269e813de
Acceso en línea:https://investigacion.unirioja.es/documentos/5bbc6908b750603269e813de
Access Level:acceso abierto
Palabra clave:Chromatography
Computer-assisted methods
Conformation
Cyclohexanes
Diels-Alder reactions
Peptide analogues/mimetics
Resolution
Descripción
Sumario:This report describes the synthesis and the conformational analysis of the optically pure dipeptides analogues of aspartame: H-(S)-Asp-(1R,2R)-c6Phe-OMe and H-(S)-Asp-(1S,2S)-c6Phe-OMe, in which the Phe residue of aspartame has been replaced by a restricted Phe with a cyclohexane skeleton: 1-amino-2-phenylcyclohexanecarboxylic acid (c6Phe). Of these, only the dipeptide that incorporates (1R,2R)-c6Phe is sweet, whereas that incorporates (1S,2S)-c6Phe is bitter. This relationship between the absolute configuration of the dipeptides and the properties is explained through the different conformational behaviour displayed by each molecule, based on molecular mechanics and molecular dynamics calculations, including solvent effects. © 2002 Elsevier Science Ltd. All rights reserved.