Metabolomics Structure Database

 
MW REGNO: 78743
Common Name:Cys-Gly
Systematic Name:L-Cysteinyl-glycine
RefMet Name:Cys-Gly
Synonyms:Cysteinyl-glycine [PubChem Synonyms]
Exact Mass:
178.0412 (neutral)    Calculate m/z:
Formula:C5H10N2O3S
InChIKey:ZUKPVRWZDMRIEO-VKHMYHEASA-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:Dipeptides [C0004830]
Massbank MS spectra:View MS spectra
SMILES:C(C(=O)O)NC(=O)[C@H](CS)N
Studies:Available studies (via RefMet name)

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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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