Rapid Characterization and Identification of Chemical Constituents in Gentiana radix before and after Wine-Processed by UHPLC-LTQ-Orbitrap MSn

Molecules. 2018 Dec 6;23(12):3222. doi: 10.3390/molecules23123222.

Abstract

Gentiana radix is used in traditional Chinese medicine and has functions of clearing heat and drying dampness, as well as purging liver and gallbladder fire. A highly sensitive and effective strategy for rapid screening and identification of target constituents has been developed by using ultra high-performance liquid chromatography coupled with linear ion trap-Orbitrap mass spectrometry (UHPLC-LTQ-Orbitrap) in crude and wine-processed Gentiana radix. Based on the accurate mass measurement (<5 ppm), retention times, and MS fragmentation ions, 52 constituents were unambiguously or tentatively characterized from Gentiana radix, including 21 iridoids, 11 flavonoids, 19 xanthones, and a triterpenoid. This study demonstrated that the established method could be a rapid, effective analytical tool for screening and characterization of compounds in the complex systems of Gentiana radix. By comparing the structure and peak areas of chemical constituents in crude and wine-processed Gentiana radix, we found that some compounds in crude and wine-processed Gentiana radix were significantly different.

Keywords: Gentiana radix; UHPLC-LTQ-Orbitrap; characteristic fragmentation pathways; flavonoids; iridoids; wine-processing; xanthones.

MeSH terms

  • Chromatography, High Pressure Liquid
  • Drugs, Chinese Herbal / chemistry
  • Flavonoids / analysis
  • Gentiana / chemistry*
  • Plant Roots / chemistry
  • Spectrometry, Mass, Electrospray Ionization
  • Terpenes / analysis
  • Wine*
  • Xanthones / analysis

Substances

  • Drugs, Chinese Herbal
  • Flavonoids
  • Terpenes
  • Xanthones