Antioxidant activity of some natural essential oils in Vietnam: Comparison between QSAR simulation and experimental study
Vol. 129 No. 1D (2020), Original Article
Vol. 129 No. 1D (2020)

Antioxidant activity of some natural essential oils in Vietnam: Comparison between QSAR simulation and experimental study

Original Article
https://doi.org/10.26459/hueuni-jns.v129i1D.5800
Published 2020-06-30
Tran Thi Ai My
Department of Chemistry, University of Sciences, Hue University, 77 Nguyen Hue St., Hue, Vietnam
Le Trung Hieu
Department of Chemistry, University of Sciences, Hue University, 77 Nguyen Hue St., Hue, Vietnam
Nguyen Thi Thanh Hai
Department of Chemistry, University of Sciences, Hue University, 77 Nguyen Hue St., Hue, Vietnam
Ton Nu My Phuong
Department of Chemistry, University of Sciences, Hue University, 77 Nguyen Hue St., Hue, Vietnam
Huynh Thi Phuong Loan
Department of Chemistry, University of Sciences, Hue University, 77 Nguyen Hue St., Hue, Vietnam
Bui Thi Phuong Thuy
Faculty of Fundamental Science, Van Lang University, 45 Nguyen Khac Nhu Street, Ho Chi Minh, Vietnam
Nguyen Thi Ai Nhung
Department of Chemistry, University of Sciences, Hue University, 77 Nguyen Hue St., Hue, Vietnam
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Keywords

Key words
natural essential oil
antioxidant activity
QSAR
DPPH.

How to Cite

1.
My TTA, Hieu LT, Hai NTT, Phuong TNM, Loan HTP, Thuy BTP, Nhung NTA. Antioxidant activity of some natural essential oils in Vietnam: Comparison between QSAR simulation and experimental study . hueuni-jns [Internet]. 2020Jun.30 [cited 2024Nov.23];129(1D):33-41. Available from: http://222.255.146.83/index.php/hujos-ns/article/view/5800
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Abstract

The antioxidant activity of essential oils from leaves of Piper betle L. (T) and Cleistocalyx operculatus L. (V) and aerial parts of Ageratum conyzoides L. (H), indigenously grown in Thua Thien Hue province, Vietnam, is investigated. The quantitative structure–activity relationship (QSAR) model comprising 4-hydroxy-chromene-2H-one and its 26 derivatives is used to predict the radical scavenging activity of T, V, and H. The radical scavenging activity of the oils is experimentally determined with DPPH (1,1-diphenyl-2-picrylhydrazyl) via IC50 values. The experimental IC50 values are in good agreement with those obtained from the QSAR model. The IC50 value of Piper betle L. is 3.71 mg/mL, comparable to that of the strong antioxidant ascorbic acid (3.03 mg /mL).

https://doi.org/10.26459/hueuni-jns.v129i1D.5800
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