Ultrahigh-performance liquid chromatography Q-Exactive-Orbitrap mass spectrometry and molecular network analysis alongside network pharmacology to elucidate the active constituents and mechanism of action of Huahong tablet in treating pelvic inflammatory disease.
Shuang LiZhiyan LiuHaiping ZengJinyu FuMo SunChun BaoChenning ZhangPublished in: Rapid communications in mass spectrometry : RCM (2024)
The active ingredients in Huahong tablets exert therapeutic effects on pelvic inflammatory diseases by acting on multiple targets and utilising different pathways. Molecular docking confirmed the high affinity between the specific active ingredients and disease targets.
Keyphrases
- mass spectrometry
- liquid chromatography
- molecular docking
- network analysis
- high resolution mass spectrometry
- tandem mass spectrometry
- ultra high performance liquid chromatography
- oxidative stress
- high resolution
- rectal cancer
- molecular dynamics simulations
- gas chromatography
- capillary electrophoresis
- simultaneous determination
- solid phase extraction