Mass spectra-based framework for automated structural elucidation of metabolome data to explore phytochemical diversity

Mass spectra-based framework for automated structural elucidation of metabolome data to explore phytochemical diversity

A novel framework for automated elucidation of metabolite structures in liquid chromatography-mass spectrometer (LC-MS) metabolome data was constructed by integrating databases. High-resolution tandem mass spectra data automatically acquired from each metabolite signal were used for database searche...

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Bibliographic Details
Main Authors: Fumio eMatsuda, Ryo eNakabayashi, Yuji eSawada, Makoto eSuzuki, Masami Yokota Hirai, Shigehiko eKanaya, Kazuki eSaito
Format: Article
Language:English
Published: Frontiers Media S.A. 2011-08-01
Series:Frontiers in Plant Science
Subjects:
database searching
liquid chromatography-mass spectrometry
metabolite ontology
metabolome analysis
natural variations in secondary metabolite
structural elucidation
Online Access:http://journal.frontiersin.org/Journal/10.3389/fpls.2011.00040/full

Internet

http://journal.frontiersin.org/Journal/10.3389/fpls.2011.00040/full

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