Theoretical Study on Methylated Resveratrol Analogues towards the Antioxidant Activity and Mechanisms: Understanding the Structure–Activity Relationship

• Published in: Russian Journal of Physical Chemistry A Vol. 97; no. 6; pp. 1121 - 1127
• Main Author: Pei, Ling
• Format: Journal Article
• Language: English
• Published: Moscow Pleiades Publishing 01.06.2023; Springer Nature B.V
• Subjects: Antioxidants; Chemical Kinetics and Catalysis; Chemistry; Chemistry and Materials Science; Density functional theory; Electron transfer; Physical Chemistry; Protons; Reaction mechanisms; Single electrons; Solvents; Vapor phases; SPLET; HAT; SET-PT; resveratrol analogues; antioxidant activity and mechanism; density functional theory

Theoretically, the antioxidant properties of substances are usually evaluated by three working mechanisms, including H-atom transfer (HAT), single-electron transfer-proton transfer (SET-PT), and sequential proton loss electron transfer (SPLET). In this paper, the antioxidant activity of resveratrol...