Department of Analytical Chemistry, University of Granada, Granada, Spain.
J Sci Food Agric. 2019 Aug 30;99(11):4932-4941. doi: 10.1002/jsfa.9725. Epub 2019 May 13.
The oil content, composition and marketing threshold value of an avocado depends on the cultivar hence, identifying the cultivar of the avocado fruit is desirable. However, analytical methods have not been reported with this aim.
A multivariate classification tree method was proposed to discriminate three commercial botanical varieties of avocado: Hass, Fuerte and Bacon, using high-performance liquid chromatography coupled to a charged aerosol detector (HPLC-CAD). Prior to the chromatographic analysis the avocados were lyophilized and then the oil fraction was extracted using a pressurized liquid extraction system. Normal and reverse phase liquid chromatography were applied in order to obtain the chromatographic fingerprint for each sample. Soft independent modelling of class analogies (SIMCA) and partial least-squares discriminant analysis (PLS-DA) were applied. Classification quality metrics were determined to evaluate the performance of the classification. Several strategies to develop the classification models were employed. Finally, the useful application of 'classification trees' methodology, which has been scarcely applied in the field of analytical food control, was evaluated to perform a multiclass classification.
Discrimination of the three botanical varieties was achieved. The best classification was obtained when the PLS-DA is applied on the normal-phase chromatographic fingerprints. Classification trees are showed to be useful tools that provide complementary information to single concatenated models showing different results from the same prediction sample set. © 2019 Society of Chemical Industry.
鳄梨的含油量、成分和销售阈值取决于品种,因此,确定鳄梨果实的品种是可取的。然而,尚未有针对此目的的分析方法。
提出了一种多元分类树方法,用于使用高效液相色谱法与带电气溶胶检测器(HPLC-CAD)对三种商业植物品种的鳄梨进行鉴别:哈斯、富尔特和培根。在进行色谱分析之前,将鳄梨进行冷冻干燥,然后使用加压液体萃取系统提取油分。为了获得每个样品的色谱指纹图谱,应用了正相和反相液相色谱。应用软独立建模类相似性(SIMCA)和偏最小二乘判别分析(PLS-DA)。确定分类质量指标以评估分类的性能。采用了几种开发分类模型的策略。最后,评估了“分类树”方法的有用应用,该方法在分析食品控制领域很少应用,以执行多类分类。
实现了三种植物品种的区分。当将 PLS-DA 应用于正相色谱指纹图谱时,获得了最佳的分类。分类树是有用的工具,它们提供了与单个串联模型互补的信息,从相同的预测样本集中显示出不同的结果。 © 2019 化学工业协会。