Metabolomics Structure Database

 
MW REGNO: 81482
Common Name:Glu-Arg-Glu
Systematic Name:L-Glutamyl-L-arginyl-L-glutamic acid
RefMet Name:Glu-Arg-Glu
Synonyms:Glutamyl-arginyl-glutamic acid [PubChem Synonyms]
Exact Mass:
432.1969 (neutral)    Calculate m/z:
Formula:C16H28N6O8
InChIKey:CGYDXNKRIMJMLV-GUBZILKMSA-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:Tripeptides
SMILES:NC(=N)NCCC[C@@H](NC(=O)[C@H](N)CCC(O)=O)C(=O)N[C@H](CCC(O)=O)C(O)=O
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:145455300
CHEBI ID:162702

Calculated physicochemical properties:

No data available

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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