Rapid identification of chemical compositions in callicarpa kwangtungensis Chun by ultra-high-performance liquid chromatography with Q Exactive hybrid quadrupole orbitrap high-resolution accurate mass spectrometry

J Sep Sci. 2020 Jun;43(12):2487-2494. doi: 10.1002/jssc.202000165. Epub 2020 May 8.

Abstract

Callicarpa kwangtungensis Chun is a traditional Chinese medicine that has various therapeutic effects. Despite its wide use in Chinese medicine, the study is still quite limited, especially its chemical compositions. In this research, an ultra-high-pressure liquid chromatography coupled with Q Exactive hybrid quadrupole-orbitrap high-resolution accurate mass spectrometry tandem mass spectrometry method was utilized to analyze its chemical compositions for the first time. As a result, a total of 124 compounds, including 20 phenylethanoid glycosides, 31 flavonoids, 36 organic acids, 26 terpenoids and 11 phenols, were identified or tentatively characterized in 30 min. Among them, 49 compounds, including 5 phenylethanoid glycosides, 12 flavonoids, 16 organic acids, 12 terpenoids, and 4 phenols, were identified in Callicarpa kwangtungensis Chun for the first time. Besides, the fragmentation pathways were also discussed. This research established a rapid and reliable method to analyze the chemical compositions of complicated herb without the process of isolation, and provide abundant information on the chemical material basis for further bioactivity and quality control studies.

Keywords: Callicarpa kwangtungensis Chun; chemical compositions; tandem mass spectrometry; traditional Chinese medicine; ultra-high-pressure liquid chromatography.

MeSH terms

  • Callicarpa / chemistry*
  • Chromatography, High Pressure Liquid
  • Drugs, Chinese Herbal / analysis*
  • Mass Spectrometry
  • Medicine, Chinese Traditional
  • Molecular Structure

Substances

  • Drugs, Chinese Herbal