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Evaluation and prediction of the antioxidant activity of Epimedium from multi-wavelength chromatographic fingerprints and chemometrics

机译:从多波长色谱指纹图谱和化学计量学评估淫羊med的抗氧化活性

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Epimedium herbs are commonly used as herbal medicine ingredients in China. In this study, firstly the total phenolic content and total flavonoid content (TFC) of Epimedium extracts were determined, respectively. The majority of the Epimedium extracts showed strong 2,2-diphenyl-1-picrylhydrazyl (DPPH) scavenging activity, and TFC of Epimedium exhibited highly correlations with DPPH scavenging activity with high correlation coefficient (R2 = 0.9279). Then, high performance liquid chromatography fingerprints of 25 Epimedium samples (5 species) were developed. A data fusion strategy was used to construct multi-wavelength fingerprints by combining 3 profiles with peak-rich wavelengths (230, 270 and 310 nm) into a single vector for each sample. Whittaker smoother, adaptive iteratively reweighted penalized least square (airPLS) and multi-scale peak alignment methods were adopted to preprocess the constructed fingerprint matrix. Variable selection and partial least square were applied to build a calibration model between fingerprints and their antioxidant activities. The potential peaks, which respond for the antioxidant activity, were screened by the selected variable with large regression coefficient. These results suggest that water extracts of Epimedium are a source of antioxidant compounds, and proposed multi-wavelength fingerprints can be used for predicting the antioxidant activity of Epimedium.
机译:淫羊herbs草药在中国通常用作草药成分。在这项研究中,首先分别确定淫羊med提取物的总酚含量和总黄酮含量(TFC)。淫羊med提取物中的大多数显示出较强的2,2-二苯基-1-吡啶并肼基(DPPH)清除活性,淫羊T的TFC与DPPH清除活性具有高度相关性,相关系数较高(R2 = 0.9279)。然后,开发了25种淫羊samples样品(5种)的高效液相色谱指纹图谱。数据融合策略用于通过将3个具有富峰波长(230、270和310 nm)的轮廓组合到每个样本的单个矢量中来构建多波长指纹。采用Whittaker更平滑,自适应的迭代加权加权最小二乘(airPLS)和多尺度峰比对方法对构造的指纹矩阵进行预处理。应用变量选择和偏最小二乘建立指纹及其抗氧化活性之间的校正模型。通过选择的具有较大回归系数的变量筛选响应抗氧化剂活性的潜在峰。这些结果表明淫羊med的水提取物是抗氧化剂化合物的来源,并且建议的多波长指纹可用于预测淫羊med的抗氧化活性。

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