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Determination of Configuration and Conformation of a Reserpine Derivative with Seven Stereogenic Centers Using Molecular Dynamics with RDC‐Derived Tensorial Constraints

NMR‐based determination of the configuration of complex molecules containing many stereocenters is often not possible using traditional NOE data and coupling patterns. Making use of residual dipolar couplings (RDCs), we were able to determine the relative configuration of a natural product containin...

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Detalhes bibliográficos
Publicado no:Chemistry
Main Authors: Sager, Emine, Tzvetkova, Pavleta, Gossert, Alvar D., Piechon, Philippe, Luy, Burkhard
Formato: Artigo
Idioma:Inglês
Publicado em: John Wiley and Sons Inc. 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7702126/
https://ncbi.nlm.nih.gov/pubmed/32744785
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/chem.202002642
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