Metabolomics Structure Database

 
MW REGNO: 66985
Common Name:L-alpha-phenylglycine
Systematic Name:(2S)-amino(phenyl)acetic acid
RefMet Name:2-Phenylglycine
Synonyms:(alphaS)-alpha-aminobenzeneacetic acid; L-(+)-2-Phenylglycine; L-(+)-alpha-Aminophenylacetic acid; L-(+)-alpha-Phenylglycine; L-Phenylglycine [PubChem Synonyms]
Exact Mass:
151.0633 (neutral)    Calculate m/z:
Formula:C8H9NO2
InChIKey:ZGUNAGUHMKGQNY-ZETCQYMHSA-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
SMILES:c1ccc(cc1)[C@@H](C(=O)O)N
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:99291
CHEBI ID:439819
HMDB ID:HMDB0002210
Plant Metabolite Hub(Pmhub):MS000000107

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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