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Biological evaluation of gallic acid and quercetin derived from<i>Ceriops tagal</i>: insights from extensive<i>in vitro</i>and<i>in silico</i>studies

V. Sachithanandam, A. Parthiban, P. Lalitha, Jayaraman Muthukumaran, Monika Jain, Dhanasekar Elumalai, Jayabal Kamalraja, R. Sridhar, Purvaja Ramachandran, R. Ramesh

2020Journal of Biomolecular Structure and Dynamics37 citationsDOI

Abstract

) for these two molecules are 110 and 8.75 μM, respectively. The MD simulation additionally supported that quercetin molecule is significantly improved the structural stability of Bcl-B protein. The present study provides key insights about the importance of polyphenols, and thus leads to open the therapeutic route for anti-cancer drug discovery process.Communicated by Ramaswamy H. Sarma.

Topics & Concepts

Gallic acidQuercetinHeLaChemistryStereochemistryBiochemistryChromatographyAntioxidantIn vitroComputational Drug Discovery MethodsTannin, Tannase and Anticancer ActivitiesBioactive Compounds and Antitumor Agents
Biological evaluation of gallic acid and quercetin derived from<i>Ceriops tagal</i>: insights from extensive<i>in vitro</i>and<i>in silico</i>studies | Litcius