Quality assessment of Bupleurum chinense by coupling Belousov-Zhabotinsky oscillation with principal component analysis

IF 2.4 4区 化学 Q4 ELECTROCHEMISTRY International Journal of Electrochemical Science Pub Date : 2025-07-01 Epub Date: 2025-04-15 DOI:10.1016/j.ijoes.2025.101033
Na Wang , Feng Li , Xiaodong Fan
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Abstract

This study established a comprehensive analytical methodology utilizing Belousov-Zhabotinsky (B-Z) oscillation patterns coupled with principal component analysis for quality evaluation of medicinal herb extracts. The optimized system employed a two-electrode configuration with platinum working electrode (d = 2.0 mm) and demonstrated characteristic temporal evolution across three distinct phases. Systematic parameter optimization revealed optimal conditions including H2SO4 (3.0 mol/L), malonic acid (0.4 mol/L), and KBrO3 (0.3 mol/L) concentrations. High-quality samples exhibited distinctive oscillation characteristics including maximum amplitudes of 0.09–0.14 V and mean oscillation periods between 16 and 23 seconds, with amplitude decay following pseudo-first-order kinetics (decay constants 2.3 ×10−3 to 3.8 ×10−3 s−1). The analytical method showed excellent precision with relative standard deviations below 4 % for key parameters, particularly peak potentials (RSD = 1.7 %). Hierarchical cluster analysis initially revealed three distinct quality clusters; however, by further integrating quantitative oscillation parameters (e.g., ΔEₘₐₓ, induction time, and oscillation lifetime) and their correlations with traditional quality markers, these clusters were refined into five quality grades, thereby providing a more detailed evaluation framework. The method's robustness was confirmed through stability testing, showing minimal sensitivity to temperature variations ( ± 2°C) and reagent concentration fluctuations ( ± 2 %). Analysis of 30 samples from three geographical origins demonstrated clear regional quality patterns, with Q2 values of 0.85 and 0.78 for PC1 and PC2 respectively, enabling reliable geographical source discrimination.
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Belousov-Zhabotinsky振荡与主成分分析耦合评价柴胡质量
本研究建立了一种综合分析方法,利用别洛乌索夫- zhabotinsky (B-Z)振荡模式结合主成分分析法对药材提取物进行质量评价。优化后的系统采用铂工作电极(d = 2.0 mm)的双电极结构,并表现出三个不同阶段的特征时间演化。系统参数优化得到H2SO4(3.0 mol/L)、丙二酸(0.4 mol/L)和KBrO3(0.3 mol/L)的最佳浓度。高质量样品具有独特的振荡特性,包括最大振幅为0.09-0.14 V,平均振荡周期为16至23 秒,振幅衰减遵循伪一阶动力学(衰减常数为2.3 ×10−3至3.8 ×10−3 s−1)。分析方法精密度高,关键参数的相对标准偏差小于4 %,尤其是峰电位(RSD = 1.7 %)。层次聚类分析初步揭示了三个不同的质量聚类;然而,通过进一步整合定量振荡参数(例如ΔEₓ、诱导时间和振荡寿命)及其与传统质量标记的相关性,这些聚类被细化为五个质量等级,从而提供了更详细的评估框架。通过稳定性测试证实了该方法的鲁棒性,对温度变化( ± 2°C)和试剂浓度波动( ± 2 %)的敏感性最小。对来自三个地理来源的30个样本的分析显示出明显的区域质量模式,PC1和PC2的Q2值分别为0.85和0.78,能够进行可靠的地理来源区分。
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来源期刊
CiteScore
3.00
自引率
20.00%
发文量
714
审稿时长
2.6 months
期刊介绍: International Journal of Electrochemical Science is a peer-reviewed, open access journal that publishes original research articles, short communications as well as review articles in all areas of electrochemistry: Scope - Theoretical and Computational Electrochemistry - Processes on Electrodes - Electroanalytical Chemistry and Sensor Science - Corrosion - Electrochemical Energy Conversion and Storage - Electrochemical Engineering - Coatings - Electrochemical Synthesis - Bioelectrochemistry - Molecular Electrochemistry
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