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Flavonoid Content During the Growth and Floral Development of Calendula officinalis L.
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[Density functional theory investigation on antioxidation activity of four flavonoids from Rhododendri Daurici
Dong-Bao Hu1, Jian-Xiong Zhao1
1College of Resource and Environment, Yuxi Normal University, Yuxi 653100, China.
Abstract:
Four main flavonoids of the Chinese medicine Rhododendri Daurici Folium were studied using the density functional theory (DFT) B3LYP method with 6-311 + + G (d, p) basis set.Their activities were analyzed based on molecular structure, bond dissociation energy (BDE) and the energy gap between HOMO and LUMO. As a result, the antioxidant ability order of the four flavonoids compounds is farrerol
Keywords:
DFTRhododendri Daurici Foliumantioxidant activitiesbond dissociation energy (BDE)chemical compositionMore Related Videos
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