Tankeu Sidonie, Vermaak Ilze, Chen Weiyang, Sandasi Maxleene, Kamatou Guy, Viljoen Alvaro
Department of Pharmaceutical Sciences, Faculty of Science, Tshwane University of Technology, Pretoria, South Africa.
SAMRC Herbal Drugs Research Unit, Faculty of Science, Tshwane University of Technology, Pretoria, South Africa.
Planta Med. 2018 Apr;84(6-07):407-419. doi: 10.1055/s-0043-119887. Epub 2017 Oct 6.
(black cohosh) has a history of traditional use in the treatment of general gynecological problems. However, the plant is known to be vulnerable to adulteration with other cohosh species. This study evaluated the use of shortwave infrared hyperspectral imaging (SWIR-HSI) in tandem with chemometric data analysis as a fast alternative method for the discrimination of four cohosh species () and 36 commercial products labelled as black cohosh. The raw material and commercial products were analyzed using SWIR-HSI and ultra-high-performance liquid chromatography coupled to mass spectrometry (UHPLC-MS) followed by chemometric modeling. From SWIR-HSI data (920 - 2514 nm), the range containing the discriminating information of the four species was identified as 1204 - 1480 nm using Matlab software. After reduction of the data set range, partial least squares discriminant analysis (PLS-DA) and support vector machine discriminant analysis (SVM-DA) models with coefficients of determination ( ) of ≥ 0.8 were created. The novel SVM-DA model showed better predictions and was used to predict the commercial product content. Seven out of 36 commercial products were recognized by the SVM-DA model as being true black cohosh while 29 products indicated adulteration. Analysis of the UHPLC-MS data demonstrated that six commercial products could be authentic black cohosh. This was confirmed using the fragmentation patterns of three black cohosh markers (cimiracemoside C; 12-,21-dihydroxycimigenol-3--L-arabinoside; and 24--acetylhydroshengmanol-3---D-xylopyranoside). SWIR-HSI in conjunction with chemometric tools (SVM-DA) could identify 80% adulteration of commercial products labelled as black cohosh.
黑升麻在传统上有用于治疗一般妇科问题的历史。然而,已知该植物容易被其他升麻属物种掺假。本研究评估了将短波红外高光谱成像(SWIR-HSI)与化学计量数据分析相结合,作为一种快速的替代方法,用于鉴别四种升麻属物种以及36种标为黑升麻的商业产品。使用SWIR-HSI和超高效液相色谱-质谱联用(UHPLC-MS)对原材料和商业产品进行分析,随后进行化学计量建模。从SWIR-HSI数据(920 - 2514 nm)中,使用Matlab软件将包含四种物种鉴别信息的范围确定为1204 - 1480 nm。在缩小数据集范围后,创建了决定系数( )≥0.8的偏最小二乘判别分析(PLS-DA)和支持向量机判别分析(SVM-DA)模型。新型的SVM-DA模型显示出更好的预测效果,并用于预测商业产品的含量。36种商业产品中有7种被SVM-DA模型识别为真正的黑升麻,而29种产品显示掺假。UHPLC-MS数据分析表明,有6种商业产品可能是正宗的黑升麻。这通过三种黑升麻标志物(升麻新苷C;12,21-二羟基升麻醇-3-O-L-阿拉伯糖苷;和24-O-乙酰基氢化升麻醇-3-O-D-木糖苷)的碎片模式得到了证实。SWIR-HSI结合化学计量工具(SVM-DA)可以识别出标为黑升麻的商业产品中80%的掺假情况。