Metabolomics Structure Database

 
MW REGNO: 1976
Common Name:Azelaic acid
Systematic Name:Nonanedioic acid
Synonyms: [PubChem Synonyms]
Exact Mass:
188.1049 (neutral)    Calculate m/z:
Formula:C9H16O4
InChIKey:BDJRBEYXGGNYIS-UHFFFAOYSA-N
LIPID MAPS Category:Fatty Acyls [FA]
LIPID MAPS mainclass:Fatty Acids and Conjugates [FA01]
LIPID MAPS subclass:Dicarboxylic acids [FA0117]
MoNA MS spectra:View spectra
Studies:Available studies

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External database links:

PubChem CID:2266
LIPID MAPS ID:LMFA01170054
CHEBI ID:48131
HMDB ID:HMDB0000784
KEGG ID:C08261
Chemspider ID:2179
METLIN ID:5750
MetaCyc ID:CPD0-1265

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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