黄酮类
轨道轨道
化学
质谱法
碎片(计算)
色谱法
注释
高效液相色谱法
主成分分析
生物信息学
计算机科学
生物
人工智能
生态学
作者
Jiayi Zhong,Dabing Ren,Ying Shang,Sichen Huang,Yan Li,Yongdan Hu,Lunzhao Yi
出处
期刊:Food Chemistry
[Elsevier BV]
日期:2021-12-27
卷期号:377: 131901-131901
被引量:16
标识
DOI:10.1016/j.foodchem.2021.131901
摘要
Glycosylated flavones (GFs) are important components of green tea and have various structures and isomers. The annotation of GFs' chemical structures is challenging. Ultrahigh-performance liquid chromatography-high resolution mass spectrometry can provide informative mass ions for GF annotation. However, distinguishing the mass features of GFs from those of thousands of ions is difficult. In this study, integrated ion-filtering strategies for O- and C-glycosyl flavones were constructed, and the mass-fragmentation characteristics were summarized from GF standards. Ultimately, 29 GFs with different types of aglycones and glycosides, connection modes, and locations were annotated. According to principal component analysis and t-test results, significant differences were observed in the contents of 16 components in the two kinds of tea. Among them, the contents of 11 GFs in autumn teas were significantly higher than those in spring teas. This study provided an efficient strategy for isomer annotation in food analysis.
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