Antioxidative and Inhibitor Activity of Alizarin-2-Glycoside
Antioksidativna i inhibitorska aktivnost Alizarin-2-glikozida

2018
Authors
Avdović, EdinaJeremić, Svetlana
Amić, Ana
Pirković, Marijana
Milenković, Dejan
Djorović, Jelena
Marković, Zoran
conferenceObject (publishedVersion)

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In this paper was investigated the antioxidative activity of alizarin-2-glycoside. All results were obtained using the DFT method. For calculations, the M06-2X method was used in combination with the 6-311++G(d,p) base set. Water was used as a solvent. The values of enthalpy were used as thermodynamic parameters on the basis of which the antioxidative capacity of alizarin-2-glycoside was evaluated. The Molecular Docking method was used for assessing the ability of alizarin-2-glycoside to inhibit the negative effect of P-glycoprotein.
U ovom radu je ispitana antioksidativna aktivnost alizarin-2-glikozida. Svi rezultati dobijeni su primenom DFT metode. Za izračunavanja je korišćena M06-2X metoda u kombinaciji sa 6-311++G(d,p) bazisnim skupom. Kao rastvarač korišćena je voda. Vrednosti entalpija korišćene su kao termodinamički parametri na osnovu kojih je procenjen antioksidativni kapacitet alizarin-2-glikozida. Molecular Docking metodom procenjena je sposobnost alizarin-2-glikozida da inhibira negativan uticaj P-glikoproteina.
Keywords:
alizarin-2-glycoside / antioxidant activity / DFT / enthalpy / P-glycoprotein / antioksidativna aktivnost / entalpijaSource:
23. Savetovanje o biotehnologiji sa međunarodnim učešćem, Čačak, 09.-10. 03. 2018., 2018Funding / projects:
- info:eu-repo/grantAgreement/MESTD/Basic Research (BR or ON)/172015/RS// (RS-172015)
- info:eu-repo/grantAgreement/MESTD/Basic Research (BR or ON)/172016/RS// (RS-172016)
- info:eu-repo/grantAgreement/MESTD/Basic Research (BR or ON)/174028/RS// (RS-174028)