Metabolomics Structure Database

 
MW REGNO: 37085
Common Name:Glycine
Systematic Name:2-aminoacetic acid
RefMet Name:Glycine
Synonyms: [PubChem Synonyms]
Exact Mass:
75.0320 (neutral)    Calculate m/z:
Formula:C2H5NO2
InChIKey:DHMQDGOQFOQNFH-UHFFFAOYSA-N
ClassyFire superclass:Organic acids and derivatives [C0000264]
ClassyFire class:Carboxylic acids and derivatives [C0000265]
ClassyFire subclass:Amino acids, peptides, and analogues [C0000013]
ClassyFire direct parent:Alpha amino acids [C0002404]
MoNA MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:C(C(=O)O)N
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

External database links:

PubChem CID:750
CHEBI ID:15428
HMDB ID:HMDB0000123
KEGG ID:C00037
Chemspider ID:730
METLIN ID:20
BMRB ID:bmse000977
MetaCyc ID:GLY
NP-MRD ID(NMR):NP0000959
EPA CompTox DB:DTXCID90667
Plant Metabolite Hub(Pmhub):MS000006656

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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