Citation: KONG Hongwei, DAI Weidong, XU Guowang. Advances of metabolite identification in liquid chromatography-mass spectrometry based metabolomics[J]. Chinese Journal of Chromatography, ;2014, 32(10): 1052-1057. doi: 10.3724/SP.J.1123.2014.05017 shu

Advances of metabolite identification in liquid chromatography-mass spectrometry based metabolomics

1.
Key Laboratory of Separation Science for Analytical Chemistry, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian 116023, China

Corresponding author: XU Guowang,
Received Date: 19 May 2014

Fund Project: 科技部国际科技合作项目(2009DFA41250) (2009DFA41250)国家自然科学基金重点项目(21435006). (21435006)

Liquid chromatography-mass spectrometry (LC-MS) based metabolomics has become an important approach in life science research due to its powerful separation and high sensitivity detection. However, because of the lack of an effective mass spectra library for metabolite identification, a vast amount of detected metabolites are unable to be identified. The improvement of the metabolite coverage and the discovery of biomarkers are harmed, leading to the severe loss of chemical and biological information. The metabolite identification has become a major bottleneck in metabolomics studies. This review describes recent advances of metabolite identification based on atmospheric pressure ionization (API)-MS data. In particular, it focuses on the advances in mass spectrometer instruments, assignment of elemental compositions, database and spectral search, computer-aided spectral interpretation, etc.
- metabolomics,
- liquid chromatography-mass spectrometry (LC-MS),
- atmospheric pressure ionization mass spectrometry (API-MS),
- identification,
- review
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