ПросмотрChemistry по теме "ADMET"

Отображаемые элементы 1-2 из 2

    • Isolation and In Silico SARS-CoV-2 Main Protease Inhibition Potential of Jusan Coumarin, a New Dicoumarin from Artemisia glauca 

      Suleimen, Yerlan M.; Jose, Rani A.; Suleimen, Raigul N.; Ishmuratova, Margarita Y.; Toppet, Suzanne; Dehaen, Wim; Alsfouk, Aisha A.; Elkaeed, Eslam B.; Eissa, Ibrahim H.; Metwaly, Ahmed M. (2022)
      A new dicoumarin, jusan coumarin, (1), has been isolated from Artemisia glauca aerial parts. The chemical structure of jusan coumarin was estimated, by 1D, 2D NMR as well as HR-Ms spectroscopic methods, to be 7-hydroxy-6-methoxy-3-[(2-oxo-2H-chromen-6-yl)oxy]-2H-chromen-2- one. As the first time to be introduced in nature, its potential against SARS-CoV-2 has been estimated using ...
      2024-09-20

    • Jusanin, a New Flavonoid from Artemisia commutata with an In Silico Inhibitory Potential against the SARS-CoV-2 Main Protease 

      Suleimen, Yerlan M.; Jose, Rani A.; Suleimen, Raigul N.; Arenz, Christoph; Ishmuratova, Margarita Y.; Toppet, Suzanne; Dehaen, Wim; Alsfouk, Bshra A.; Elkaeed, Eslam B.; Eissa, Ibrahim H.; Metwaly, Ahmed M. (Molecules, 2022)
      A new flavonoid, Jusanin, (1) has been isolated from the aerial parts of Artemisia commutata. The chemical structure of Jusanin has been elucidated using 1D, 2D NMR, and HR-Ms spectroscopic methods to be 5,20 ,40 -trihydroxy-6,7,50 -trimethoxyflavone. Being new in nature, the inhibition potential of 1 has been estimated against SARS-CoV-2 using different in silico techniques. ...
      2024-09-20