Cargando...

Tautomerism of Warfarin: Combined Chemoinformatics, Quantum Chemical, and NMR Investigation

Warfarin, an important anticoagulant drug, can exist in solution in 40 distinct tautomeric forms through both prototropic tautomerism and ring–chain tautomerism. We have investigated all warfarin tautomers with computational and NMR approaches. Relative energies calculated at the B3LYP/6-311G+ +(d,p...

Descrición completa

Gardado en:
Detalles Bibliográficos
Publicado en:J Org Chem
Main Authors: Guasch, Laura, Peach, Megan L., Nicklaus, Marc C.
Formato: Artigo
Idioma:Inglês
Publicado: 2015
Assuntos:
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC7724503/
https://ncbi.nlm.nih.gov/pubmed/26372257
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.joc.5b01370
Tags: Engadir etiqueta
Sen Etiquetas, Sexa o primeiro en etiquetar este rexistro!