Based on UPLC-Q-TOF-MS/MS and Network Pharmacology to Explore the Potential Analgesic Mechanism of Shuanghu Zhongtongning Tincture
10.13748/j.cnki.issn1007-7693.20223473
- VernacularTitle:基于UPLC-Q-TOF-MS/MS和网络药理学探讨双虎肿痛宁酊剂镇痛潜在作用机制
- Author:
LEI Mengying
1
;
HUANG Xin
1
;
JIANG Xinrui
1
;
HUANG Xiaomei
1
;
LIANG Fenlan
1
;
WU Huijie
1
;
ZHOU Yanlin
2
;
WANG Gang
1
,
3
Author Information
1. Guangxi University of Chinese Medicine, Nanning 530200, China
2. Guilin Sanjin Pharmaceutical Company Limited, Guilin 541004, China
3. Zhuang Yao Medicine Center of Engineering and Technology, Nanning 530200, China
- Publication Type:Journal Article
- Keywords:
Shuanghu Zhongtongning tincture;
UPLC-Q-TOF-MS/MS;
chemical composition;
network pharmacology;
anti-inflammatory analgesic;
target;
pathway
- From:
Chinese Journal of Modern Applied Pharmacy
2023;40(18):2492-2498
- CountryChina
- Language:Chinese
-
Abstract:
OBJECTIVE To study the chemical composition and analgesia molecular mechanism of Shuanghu Zhongtongning tincture by UPLC-Q-TOF-MS/MS and network pharmacology. METHODS By comparing the chromatogram and blank chromatogram of Shuanghu Zhongtongning tincture, combined with PubChem, HMDB, MassBank database spectrum and the lysis information of reference substance, the chemical composition of Shuanghu Zhongtongning tincture was analyzed and identified. Protein-protein interaction network was constructed by using STRING database, and potential targets of analgesic effect of Shuanghu Zhongtongning tincture were screened. And GO and KEGG enrichment analysis were performed to analyze the core pathways related to analgesia. The network of "chemical composition-disease-target" was constructed by Cytoscape software to analyze the key compounds related to analgesia. RESULTS Seventeen core components of neochlorogenic acid, chlorogenic acid, hesperidin, neohesperidin, ferulic acid, berberine, ursolic acid, deoxyaconitine, mesaconitine, hypaconitine, benzoylmesaconine, benzoylhypacoitine, caffeic acid, quercetin, oleanolic acid, 4-hydroxycinnamic acid and mefenamic acid were identified, 3 core targets of STAT3, MAPK3 and MAPK1 were found, and 4 key signaling pathways of IL-17, TNF, PI3K-Akt and arachidonic metabolism were revealed. CONCLUSION This study preliminarily clarifies the chemical composition of Shuanghu Zhongtongning tincture and potential mechanism of analgesic effect, and provides a scientific theoretical basis for the study on the material basis and mechanism of Shuanghu Zhongtongning tincture.
