Systematic characterization of the absorbed components of Ligustri Lucidi Fructus and their metabolic pathways in rat plasma by ultra‐high‐performance liquid chromatography‐Q‐Exactive Orbitrap tandem mass spectrometry combined with network pharmacology

葡萄糖醛酸化 化学 代谢途径 色谱法 代谢组学 轨道轨道 硫酸化 羟基化 去甲基化 液相色谱-质谱法 质谱法 生物化学 新陈代谢 体外 微粒体 基因表达 基因 DNA甲基化
作者
Danjie Zhang,Lewen Xiong,Linlin Fang,Huifei Li,Xin Zhao,Ruqiao Luan,Peng Zhao,Xuelan Zhang
出处
期刊:Journal of Separation Science [Wiley]
卷期号:44 (24): 4343-4367 被引量:5
标识
DOI:10.1002/jssc.202100484
摘要

Ligustri Lucidi Fructus is a dried and mature fruit of Ligustrum lucidum Ait., which has the effects of nourishing liver and kidney. Herein, an accurate and sensitive method was established for the separation and identification of the absorbed constituents and metabolites of Ligustri Lucidi Fructus in rat plasma based on ultra-high-performance liquid chromatography-Q-Exactive Orbitrap tandem mass spectrometry. A total of 73 prototype constituents and 148 metabolites were identified or characterized in administered plasma, and the possible metabolic pathways of constituents mainly involved hydroxylation, sulfation, demethylation, and glucuronidation. Besides, the network pharmacology was further investigated to illuminate its potential mechanism of treatment for liver injury by the biological targets regulating related pathways. Network pharmacological analysis showed that target components through 399 targets regulate 220 pathways. The docking results showed that 36 key target components were closely related to liver injury. Overall, the study clearly presented the metabolic processes of Ligustri Lucidi Fructus and gave a comprehensive metabolic profile of Ligustri Lucidi Fructus in vivo first. Combining with network pharmacology and molecular docking discovered potential drug targets and disclose the biological processes of Ligustri Lucidi Fructus, which will be a viable step toward uncovering the secret mask of study for traditional Chinese medicine.
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