101. Cis-glyco-fused benzopyran compounds as new amyloid β peptide ligands
- Author
-
Cristina Airoldi, Laura Colombo, Francisco Cardona, Mario Salmona, Francesco Nicotra, Erika Sironi, Barbara La Ferla, Artur M. S. Silva, Airoldi, C, Cardona, F, Sironi, E, Colombo, L, Salmona, M, Silva, A, Nicotra, F, and LA FERLA, B
- Subjects
Stereochemistry ,Ligands ,010402 general chemistry ,01 natural sciences ,Molecular mechanics ,Catalysis ,Beta amyloid peptides, glycofused compounds, Abeta ligands ,chemistry.chemical_compound ,Molecular dynamics ,CHIM/06 - CHIMICA ORGANICA ,Materials Chemistry ,Benzopyrans ,Amyloid beta-Peptides ,010405 organic chemistry ,Metals and Alloys ,Stereoisomerism ,General Chemistry ,Combinatorial chemistry ,Amyloid β peptide ,0104 chemical sciences ,Surfaces, Coatings and Films ,Electronic, Optical and Magnetic Materials ,Benzopyran ,chemistry ,Ceramics and Composites ,Protein Binding - Abstract
A small library of glyco-fused benzopyran compounds has been synthesised. Their interaction features with Aβ peptides have been characterised by using STD-NMR and trNOESY experiments. The conformational analysis of the compounds has also been carried out through molecular mechanics (MM) and molecular dynamics (MD) simulations.
- Published
- 2011