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基于超高效液相色谱-四极杆-静电场轨道阱质谱联用仪和网络药理学的肺宁颗粒治疗慢性支气管炎的快速化学表征及药理机制研究

Rapid chemical characterization and pharmacological mechanism of Fining Granules in the treatment of chronic bronchitis based on UHPLC-Q-exactive orbitrap mass spectrometer and network pharmacology.

作者信息

Li Jiaxin, Chen Yuqi, Yu Kaiquan, Zhang Min, Li Qing, Tang Sunv, Liu Yanlan, Li Hui, Zhang Zaiqi

机构信息

School of Pharmaceutical Sciences, Hunan Provincial Key Laboratory of Dong Medicine, Hunan University of Medicine, Huaihua, 418000, China.

Nursing School, Hunan University of Medicine, Huaihua, Hunan Province, 418000, China.

出版信息

Heliyon. 2024 May 23;10(11):e31804. doi: 10.1016/j.heliyon.2024.e31804. eCollection 2024 Jun 15.

Abstract

BACKGROUND

Less. is a perennial herb belonging to the Compositae family that has been used in traditional medicine as an antitussive and expectorant for treating chronic bronchitis and acute respiratory infections. Traditionally, Feining Granules are prepared from water extracts of the raw plant material. However, the chemical composition and pharmacological mechanisms of Feining Granules have not been thoroughly investigated.

METHODS

A systematic strategy for the rapid detection and identification of the constituents of Feining Granules was developed using ultrahigh-performance liquid chromatography-quadrupole-exactive orbitrap mass spectrometry (MS) with parallel reaction monitoring.

RESULTS

Overall, 162 compounds, including flavonoids, alkaloids, organic acids, and others, were identified unambiguously and tentatively by comparing the retention times and MS fragmentation with reference standards and literature data. Ninety-nine of these were reported for the first time to the best of our knowledge. Network pharmacology suggests that Feining Granules can be used to treat chronic bronchitis as they contain active components associated with the , , and target genes influenced by HIF-1, VEGF, and other signaling pathways.

CONCLUSION

These results provide information that can help understand the effective substances of Less. and improve quality control.

摘要

背景

款冬是一种菊科多年生草本植物,在传统医学中用作镇咳祛痰药,用于治疗慢性支气管炎和急性呼吸道感染。传统上,肺宁颗粒由生药材的水提取物制备。然而,肺宁颗粒的化学成分和药理机制尚未得到充分研究。

方法

采用超高效液相色谱-四极杆-高分辨轨道阱质谱(MS)并行反应监测技术,建立了一种快速检测和鉴定肺宁颗粒成分的系统策略。

结果

通过与参考标准品和文献数据比较保留时间和MS碎片,共明确鉴定和初步鉴定了162种化合物,包括黄酮类、生物碱类、有机酸类等。据我们所知,其中99种是首次报道。网络药理学表明,肺宁颗粒可用于治疗慢性支气管炎,因为它们含有与受HIF-1、VEGF等信号通路影响的、和靶基因相关的活性成分。

结论

这些结果为理解款冬的有效物质和改进质量控制提供了信息。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5444/11154603/f6ab0735ba88/gr1.jpg

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