Unexpected role of 5-OH in DPPH radical-scavenging activity of 4-thiaflavans. Revealed by theoretical calculations

Bioorganic and Medicinal Chemistry Letters

Volumn 14, Issue 10, 2004, Pages 2609-2611

  Wang, Lan Fen ^a   Zhang, Hong Yu ^a  

^a SHANDONG UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

DFT method; DPPH radical; Flavonoids; O H bond dissociation enthalpy; Substituent effect; Thiaflavans

Indexed keywords

1,1 DIPHENYL 2 PICRYLHYDRAZYL; FLAVAN DERIVATIVE; HYDROGEN; OXYGEN; SCAVENGER;

ARTICLE; DENSITY FUNCTIONAL THEORY; ENTHALPY; HYDROGEN BOND; MATHEMATICAL COMPUTING;

ANTIOXIDANTS; FLAVONOIDS; FREE RADICAL SCAVENGERS; HYDROXYL RADICAL; MODELS, THEORETICAL; PICRATES; STRUCTURE-ACTIVITY RELATIONSHIP; THERMODYNAMICS;

EID: 1942534239     PISSN: 0960894X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmcl.2004.02.066     Document Type: Article

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