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Synergistic Combination of NAPROC-13 and NMR (13)C DFT Calculations: A Powerful Approach for Revising the Structure of Natural Products

[Image: see text] This article describes the structure revision of nine triterpenoids that have been reported corresponding to the same (13)C NMR data set. In addition, (13)C NMR calculation shows that some chemical shift assignments must be swapped. Our analysis improves the fit between the experim...

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Detalles Bibliográficos
Autores principales:	Sánchez-Martínez, Hugo A., Morán-Pinzón, Juan A., del Olmo Fernández, Esther, Eguiluz, David López, Adserias Vistué, José F., López-Pérez, José L., De León, Estela Guerrero
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society and American Society of Pharmacognosy 2023
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10616860/ https://www.ncbi.nlm.nih.gov/pubmed/37675572 http://dx.doi.org/10.1021/acs.jnatprod.3c00437

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