机器学习支持的风味学在不同的提取工艺下解读莉花精油中香味配置文件的分子基础
Ziyang Wu1, Zhangcheng Liang2, Hang Wei3
1College of Food Science, Fujian Agriculture and Forestry University, Fuzhou 350002, China; Fujian Provincial Key Laboratory of Quality Science and Processing Technology in Special Starch, Fujian Agriculture and Forestry University, Fuzhou 350002, China; Engineering Research Centre of Fujian-Taiwan Special Marine Food Processing and Nutrition (Ministry of Education), Fujian Agriculture and Forestry University, Fuzhou 350002, China.
Food research international (Ottawa, Ont.)
|January 15, 2026
概括
超临界CO2提取 (SFE-CO2) 提高了莉花油的产量和香气质量. 机器学习识别了诸如龙和α-Ionone之类的关键化合物,改善了花音和减少了工业应用中的异味.
科学领域:
- 精油的化学成分 精油的化学成分
- 这就是Flavoromics.
- 食品科学 食品科学 食品科学
背景情况:
- 莉花精油对于香水和食物至关重要.
- 传统的提取方法产生的油量较少,失去味道.
- 优化提取对于工业应用至关重要.
研究的目的:
- 使用风味学和机器学习分析莉花油香味质量.
- 为了比较四种不同的提取方法,包括SFE-CO2和UAHD.
- 识别关键的芳香化合物及其对整体香味特征的影响.
主要方法:
- 风味学方法与气体染色学-离子移动光谱学 (GC-IMS) 和气体染色学-质谱学 (GC-MS) 相结合.
- 超临界CO2提取 (SFE-CO2) 和超声波辅助水蒸 (UAHD) 是被评估的四种方法之一.
- 使用XGBoost-SHAP机器学习模型来分析挥发性成分及其对气味的贡献.
主要成果:
- SFE-CO2显著增加了石油产量和抗氧化剂活性.
- UAHD显示出最高的血管酶转化酶 (ACE) 抑制活性.
- GC-IMS和GC-MS确定了121种挥发性化合物,其中65种具有特征的挥发性物质和57种关键的芳香化合物.
- 发现特定的化合物,如龙,α-Ionone,乙酸和利蒙会影响花,脂肪和草的气味.
结论:
- 对于莉花油提取,SFE-CO2提供了卓越的产量和抗氧化特性.
- UAHD对于提取具有 ACE 抑制活性的化合物是有效的.
- 机器学习有效地阐明了挥发性化合物对莉花油气味的协同作用和掩盖作用,为工业优化提供了基础.
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