Chemical fingerprint and metabolic profile analysis of ethyl acetate fraction of Gastrodia elata by ultra performance liquid chromatography/quadrupole-time of flight mass spectrometry

J Chromatogr B Analyt Technol Biomed Life Sci. 2016 Feb 1:1011:233-9. doi: 10.1016/j.jchromb.2015.09.043. Epub 2015 Nov 17.

Abstract

The chemical fingerprint and metabolic profile of traditional Chinese medicine is very complicated and has been a great challenge. In the present study, chemical fingerprint of ethyl acetate fraction of Gastrodia elata (EtAcGE) and metabolic profile of rat plasma sample after intragastric administration of EtAcGE (2.5g/kg) were investigated using ultra-high performance liquid chromatography coupled with quadrupole-time of flight mass spectrometry (UPLC/Q-TOF MS). A total of 38 chemical constituents of EtAcGE were identified by comparing their retention time, accurate molecular mass and characteristic fragment ions with those of references, or tentatively characterized by comparing molecular formula, fragment ions with that of known compound or information available in literature. And 40 compounds were detected in dosed rat plasma sample, including 16 prototypes and 24 metabolites underwent metabolic process of glucuronidation, glucosylation, sulfation, methylation, hydroxylation, dehydrogenation or mixed modes. The metabolic "soft spots" was hydroxyl or carboxy group. This is the first research for chemical fingerprint and metabolic profile of EtAcGE, which lay a foundation for the further investigation of EtAcGE.

Keywords: 3,4-Dihydroxy benzaldehyde (PubChem CID: 8768); 4,4-Dihydroxydiphenylmethane (PubChem CID: 12111); Chemical fingerprint; EtAcGE; Metabolic profile; UPLC/Q-TOF MS; p-Hydroxybenzaldehyde (PubChem CID: 126); p-Hydroxybenzoic acid (PubChem CID: 135); p-Hydroxybenzyl alcohol (PubChem CID: 125).

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Acetates
  • Animals
  • Chromatography, High Pressure Liquid / methods*
  • Gastrodia / chemistry*
  • Male
  • Mass Spectrometry / methods*
  • Plant Extracts / blood*
  • Plant Extracts / metabolism
  • Plant Extracts / pharmacokinetics
  • Rats
  • Rats, Sprague-Dawley
  • Reproducibility of Results

Substances

  • Acetates
  • Plant Extracts
  • ethyl acetate