Metabolomics Structure Database

 
MW REGNO: 37080
Common Name:Glycolic acid
Systematic Name:2-hydroxyacetic acid
RefMet Name:Glycolic acid
Synonyms: [PubChem Synonyms]
Exact Mass:
76.0160 (neutral)    Calculate m/z:
Formula:C2H4O3
InChIKey:AEMRFAOFKBGASW-UHFFFAOYSA-N
ClassyFire superclass:Organic acids and derivatives [C0000264]
ClassyFire class:Hydroxy acids and derivatives [C0000472]
ClassyFire subclass:Alpha hydroxy acids and derivatives [C0001359]
ClassyFire direct parent:Alpha hydroxy acids and derivatives [C0001359]
MoNA MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:C(C(=O)O)O
Studies:Available studies (via RefMet name)

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Human Pathway links:

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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