Metabolomics Structure Database

 
MW REGNO: 37135
Common Name:Oxoglutaric acid
Systematic Name:2-oxopentanedioic acid
Synonyms:alpha-ketoglutaric acid; alpha-ketoglutarate; Oxoglutarate [PubChem Synonyms]
Exact Mass:
146.0215 (neutral)    Calculate m/z:
Formula:C5H6O5
InChIKey:KPGXRSRHYNQIFN-UHFFFAOYSA-N
ClassyFire superclass:Organic acids and derivatives [C0000264]
ClassyFire class:Keto acids and derivatives [C0000389]
ClassyFire subclass:Gamma-keto acids and derivatives [C0001115]
ClassyFire direct parent:Gamma-keto acids and derivatives [C0001115]
MoNA MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:OC(=O)CCC(=O)C(O)=O
Studies:Available studies

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Human Pathway links:

HMDB and KEGG pathways containing this metabolite

REACTOME pathways containing this metabolite

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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