Published in

Elsevier, Journal of Lipid Research, 6(54), p. 1523-1530, 2013

DOI: 10.1194/jlr.m033506

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Shorthand notation for lipid structures derived from mass spectrometry

This paper is made freely available by the publisher.
This paper is made freely available by the publisher.

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Data provided by SHERPA/RoMEO

Abstract

There is a need for a standardized, practical annotation for structures of lipid species derived from mass spectrometric approaches, i.e., for high-throughput data obtained from instruments operating in either high- or low-resolution modes. This proposal is based on common, officially accepted terms, and builds upon the LIPID MAPS terminology. It aims to add defined levels of information below the LIPID MAPS nomenclature, since detailed chemical structures including stereochemistry are usually not automatically provided by mass spectrometric analysis. To this end, rules for lipid species annotation were developed which reflect the structural information derived from the analysis. For example, commonly used head group-specific analysis of glycerophospholipids by low resolution instruments is neither capable of differentiating the fatty acids linked to the glycerol backbone, nor able to define their bond type (ester, alkyl- or alk-1-enyl-ether). This and other missing structural information is covered by the proposed shorthand notation presented here. Beyond glycerophospholipids (GP), we provide shorthand notation for fatty acids/acyls (FA), glycerolipids (GL), spingolipids (SP), and sterols (ST). In summary, this defined shorthand nomenclature provides a standard methodology to report lipid species from mass spectrometric analysis required also for construction of data bases.