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CHEBI:177259 - Phenylalanyl-Aspartate

ChEBI IDCHEBI:177259
ChEBI NamePhenylalanyl-Aspartate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16N2O5
Net Charge0
Average Mass280.280
Monoisotopic Mass280.10592
SMILESNC(Cc1ccccc1)C(=O)NC(CC(=O)O)C(=O)O
InChIInChI=1S/C13H16N2O5/c14-9(6-8-4-2-1-3-5-8)12(18)15-10(13(19)20)7-11(16)17/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)
InChIKeyHWMGTNOVUDIKRE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) liver (BTO:0000759) Article Strain: C57BL/6J [EFO:0000606]
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Phenylalanyl-Aspartate (CHEBI:177259) is a dipeptide (CHEBI:46761)
IUPAC Name 
2-[(2-amino-3-phenylpropanoyl)amino]butanedioic acid
Manual XrefsDatabases
HMDB0028991HMDB
296912ChemSpider