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基于化学计量学技术的减肥中药丸色谱指纹图谱:一种掺假鉴定方法

Chromatographic fingerprinting through chemometric techniques for herbal slimming pills: A way of adulterant identification.

作者信息

Shekari Nafiseh, Vosough Maryam, Tabar Heidar Kourosh

机构信息

Chemistry and Chemical Engineering Research Center of Iran, P.O. Box 14335-186, Tehran, Iran.

Chemistry and Chemical Engineering Research Center of Iran, P.O. Box 14335-186, Tehran, Iran.

出版信息

Forensic Sci Int. 2018 May;286:213-222. doi: 10.1016/j.forsciint.2018.03.022. Epub 2018 Mar 19.

Abstract

In the current study, gas chromatography-mass spectrometry (GC-MS) fingerprinting of herbal slimming pills assisted by chemometric methods has been presented. Deconvolution of two-way chromatographic signals of nine herbal slimming pills into pure chromatographic and spectral patterns was performed. The peak clusters were resolved using multivariate curve resolution-alternating least squares (MCR-ALS) by employing appropriate constraints. It was revealed that more useful chemical information about the composition of the slimming pills can be obtained by employing sophisticated GC-MS method coupled with proper chemometric tools yielding the extended number of identified constituents. The thorough fingerprinting of the complex mixtures proved the presence of some toxic or carcinogen components, such as toluene, furfural, furfuryl alcohol, styrene, itaconic anhydride, citraconic anhydride, trimethyl phosphate, phenol, pyrocatechol, p-propenylanisole and pyrogallol. In addition, some samples were shown to be adulterated with undeclared ingredients, including stimulants, anorexiant and laxatives such as phenolphthalein, amfepramone, caffeine and sibutramine.

摘要

在当前研究中,介绍了采用化学计量学方法辅助的草药减肥药丸的气相色谱 - 质谱(GC-MS)指纹图谱分析。将九种草药减肥药丸的双向色谱信号解卷积为纯色谱和光谱模式。通过采用适当的约束条件,使用多元曲线分辨 - 交替最小二乘法(MCR-ALS)解析峰簇。结果表明,通过采用先进的GC-MS方法结合适当的化学计量工具,可以获得更多关于减肥药丸成分的有用化学信息,从而鉴定出更多成分。对复杂混合物的全面指纹图谱分析证明存在一些有毒或致癌成分,如甲苯、糠醛、糠醇、苯乙烯、衣康酸酐、柠康酸酐、磷酸三甲酯、苯酚、邻苯二酚、对丙烯基苯甲醚和连苯三酚。此外,一些样品被证明掺有未申报的成分,包括兴奋剂、食欲抑制剂和泻药,如酚酞、安非拉酮、咖啡因和西布曲明。

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