N-Phenylacetylglutamine

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Systematic / IUPAC Name: 5-Amino-5-oxo-2-[(2-phenylacetyl)amino]pentanoic acid

ID: Reference541

Other Names: Phenylacetyl-L-glutamine;
α-N-Phenylacetyl-L-glutamine;
N2-(Phenylacetyl)-L-glutamine;
(S)-5-Amino-5-oxo-2-(2-phenylacetamido)pentanoic acid;
Glutamine, N2-(phenylacetyl), L-

Formula: C13H16N2O4

Class: Endogenous Metabolites

Spectral Data

N-Phenylacetylglutamine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 293
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 2/3/2015 3:13:46 PM
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Identificators

InChI InChI=1S/C13H16N2O4/c14-11(16)7-6-10(13(18)19)15-12(17)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,16)(H,15,17)(H,18,19)/t10-/m0/s1
InChI Key JFLIEFSWGNOPJJ-JTQLQIEISA-N
Canonical SMILES C1=CC=C(C=C1)CC(=O)NC(CCC(=O)N)C(=O)O
CAS 28047156
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Other Names Phenylacetyl-L-glutamine;
α-N-Phenylacetyl-L-glutamine;
N2-(Phenylacetyl)-L-glutamine;
(S)-5-Amino-5-oxo-2-(2-phenylacetamido)pentanoic acid;
Glutamine, N2-(phenylacetyl), L-

In Other Databases

HMDb HMDB06344
ChemSpider 83292
KEGG C04148
PubChem 92258
ChemIDPlus 028047156
Wikipedia Phenylacetylglutamine
ChEBI CHEBI:17884