An Androsterone‐H(2)@C(60) hybrid: Synthesis, Properties and Molecular Docking Simulations with SARS‐Cov‐2

We report the synthesis and characterization of a fullerene‐steroid hybrid that contains H(2)@C(60) and a dehydroepiandrosterone moiety synthesized by a cyclopropanation reaction with 76 % yield. Theoretical calculations at the DFT‐D3(BJ)/PBE 6‐311G(d,p) level predict the most stable conformation an...

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Detalhes bibliográficos
Publicado no:Chempluschem
Main Authors: Suárez, Margarita, Makowski, Kamil, Lemos, Reinier, Almagro, Luis, Rodríguez, Hortensia, Herranz, María Ángeles, Molero, Dolores, Ortiz, Orlando, Maroto, Enrique, Albericio, Fernando, Murata, Yasujiro, Martín, Nazario
Formato: Artigo
Idioma:Inglês
Publicado em: John Wiley and Sons Inc. 2021
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Full Papers
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8014820/
https://ncbi.nlm.nih.gov/pubmed/33540487
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/cplu.202000770
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