NIR-based classification of vegetable oils from Amazon rainforest and quantification of adulterants

IF 4 2区 农林科学 Q2 CHEMISTRY, APPLIED Journal of Food Composition and Analysis Pub Date : 2024-11-18 DOI:10.1016/j.jfca.2024.106988
Tiago Corrêa Menezes , Gerson Antônio Barra de Castro , Henrick Araujo Fernandes , Klaus Ekkehard Gutjahr , Heronides Adonias Dantas Filho , Neirivaldo Cavalcante da Silva , Kelly das Graças Fernandes Dantas
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Abstract

Amazonian vegetable oils are important non-timber forest products supporting local economies and industries, providing sustainable alternatives to logging. However, ensuring the authenticity and integrity of these oils against economic adulteration with cheaper oils necessitates the development of rapid, cost-effective, and environmentally responsible quality control methodologies. This research utilizes one-class classification models (SIMCA, DD-SIMCA, and OCPLS) based on NIR spectroscopy to distinguish ten Amazonian vegetable oils from samples adulterated with soybean, corn, and cottonseed oils, contributing to the quality assurance of these valuable resources. Additionally, Partial Least Squares (PLS) models were developed to quantify oil purity and the content of individual adulterants. DD-SIMCA demonstrated the highest accuracy in classifying oils within their respective target classes and rejecting non-target oil samples. The PLS models predicted the content of adulterant oils (expressed as %ww-1) — corn, soybean, and cotton oils — in samples containing one, two, or three adulterants, yielding RMSEP and R² values of less than 5.1 % and greater than 0.77, respectively. Purity PLS models achieved RMSEP and R² values of less than 4.0 % and greater than 0.95, respectively. The application of NIR-based chemometric models for the classification of Amazonian oils and the evaluation of adulterant content provides a novel methodology. Additionally, the NIR spectral profiles of the majority of the Amazonian oils examined in this study are presented here for the first time.
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基于近红外技术的亚马逊雨林植物油分类和掺假物质定量
亚马逊植物油是支持当地经济和产业的重要非木材森林产品,为伐木提供了可持续的替代品。然而,要确保这些植物油的真实性和完整性,防止在经济上掺杂廉价油,就必须开发快速、经济、环保的质量控制方法。本研究利用基于近红外光谱的单类分类模型(SIMCA、DD-SIMCA 和 OCPLS)来区分十种亚马逊植物油与掺杂大豆油、玉米油和棉籽油的样本,从而为这些宝贵资源的质量保证做出贡献。此外,还开发了偏最小二乘法(PLS)模型来量化油的纯度和个别掺杂物的含量。DD-SIMCA 在将油类归入各自的目标类别和剔除非目标油类样本方面表现出最高的准确性。PLS 模型可预测含有一种、两种或三种掺杂物的样品中玉米油、大豆油和棉油的掺杂物含量(以 %ww-1 表示),其 RMSEP 和 R² 值分别小于 5.1 % 和大于 0.77。纯度 PLS 模型的 RMSEP 和 R² 值分别小于 4.0 % 和大于 0.95。将基于近红外的化学计量模型应用于亚马逊油的分类和掺假成分的评估提供了一种新方法。此外,本研究还首次展示了大部分亚马逊油类的近红外光谱图谱。
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来源期刊
Journal of Food Composition and Analysis
Journal of Food Composition and Analysis 工程技术-食品科技
CiteScore
6.20
自引率
11.60%
发文量
601
审稿时长
53 days
期刊介绍: The Journal of Food Composition and Analysis publishes manuscripts on scientific aspects of data on the chemical composition of human foods, with particular emphasis on actual data on composition of foods; analytical methods; studies on the manipulation, storage, distribution and use of food composition data; and studies on the statistics, use and distribution of such data and data systems. The Journal''s basis is nutrient composition, with increasing emphasis on bioactive non-nutrient and anti-nutrient components. Papers must provide sufficient description of the food samples, analytical methods, quality control procedures and statistical treatments of the data to permit the end users of the food composition data to evaluate the appropriateness of such data in their projects. The Journal does not publish papers on: microbiological compounds; sensory quality; aromatics/volatiles in food and wine; essential oils; organoleptic characteristics of food; physical properties; or clinical papers and pharmacology-related papers.
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