Rapid prediction of nucleosides content and origin traceability of Boletus bainiugan using Fourier transform near-infrared spectroscopy combined with chemometrics

IF 4.3 2区 化学 Q1 SPECTROSCOPY
Guangmei Deng , Honggao Liu , Jieqing Li , Yuanzhong Wang
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Abstract

Boletus bainiugan has high nutritional and economic values. As one of the potential medicinal active ingredients, nucleosides have important research significance. Porcini mushrooms fraud is frequently detected on the market, including substitute inferior into superior and lack of geographical origin’s certification. This behavior results in economic loss and health damage to consumers. Fourier transform near-infrared (FT-NIR) spectroscopy is a fast, efficient and reliable analytical tool. In the present study, the effect of source environment (climatic factors) on nucleoside content is analyzed for the first time. Then, the FT-NIR spectroscopy to study the origin traceability and content prediction of Boletus bainiugan are utilized. The results indicate that the nucleoside content is associated with precipitation and temperature. The combination of synchronous two-dimensional correlation spectroscopy (2DCOS) with residual neural networks (ResNet) model obtains the precise identification of the origin of Boletus bainiugan, with an accuracy of 100%. In the prediction models of content for uridine, guanosine, and adenosine, the optimal coefficient of determination of predictive set (R2P) is 0.901, and the optimum residual prediction deviation (RPD) is 3.178. FT-NIR spectroscopy has proven to be an environmentally friendly and non-destructive analytical tool for accurate origin traceability and content prediction.

Abstract Image

利用傅立叶变换近红外光谱仪结合化学计量学快速预测牛肝菌核苷含量并溯源。
牛肝菌具有很高的营养和经济价值。作为潜在的药用活性成分之一,核苷具有重要的研究意义。市场上经常发现牛肝菌欺诈行为,包括以次充好和缺乏原产地认证。这种行为给消费者造成了经济损失和健康损害。傅立叶变换近红外光谱(FT-NIR)是一种快速、高效、可靠的分析工具。本研究首次分析了来源环境(气候因素)对核苷含量的影响。然后,利用傅立叶变换近红外光谱仪研究牛肝菌的产地溯源和含量预测。结果表明,核苷含量与沉淀和温度有关。将同步二维相关光谱(2DCOS)与残差神经网络(ResNet)模型相结合,可精确识别牛肝菌的产地,准确率达 100%。在尿苷、鸟苷和腺苷含量预测模型中,最佳预测集决定系数(R2P)为 0.901,最佳残差预测偏差(RPD)为 3.178。事实证明,傅立叶变换近红外光谱仪是一种环境友好且无损的分析工具,可用于准确溯源和含量预测。
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来源期刊
CiteScore
8.40
自引率
11.40%
发文量
1364
审稿时长
40 days
期刊介绍: Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy (SAA) is an interdisciplinary journal which spans from basic to applied aspects of optical spectroscopy in chemistry, medicine, biology, and materials science. The journal publishes original scientific papers that feature high-quality spectroscopic data and analysis. From the broad range of optical spectroscopies, the emphasis is on electronic, vibrational or rotational spectra of molecules, rather than on spectroscopy based on magnetic moments. Criteria for publication in SAA are novelty, uniqueness, and outstanding quality. Routine applications of spectroscopic techniques and computational methods are not appropriate. Topics of particular interest of Spectrochimica Acta Part A include, but are not limited to: Spectroscopy and dynamics of bioanalytical, biomedical, environmental, and atmospheric sciences, Novel experimental techniques or instrumentation for molecular spectroscopy, Novel theoretical and computational methods, Novel applications in photochemistry and photobiology, Novel interpretational approaches as well as advances in data analysis based on electronic or vibrational spectroscopy.
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