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CHEBI:73830 - Asp-Phe

ChEBI IDCHEBI:73830
ChEBI NameAsp-Phe
Stars
DefinitionA dipeptide formed from L-α-aspartyl and L-phenylalanine residues. It is obtained after the hydrolysis of aspartame in intestinal lumen.
Last Modified23 October 2015
SubmitterSteve
DownloadsMolfile
FormulaC13H16N2O5
Net Charge0
Average Mass280.280
Monoisotopic Mass280.10592
SMILESN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C13H16N2O5/c14-9(7-11(16)17)12(18)15-10(13(19)20)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)/t9-,10-/m0/s1
InChIKeyYZQCXOFQZKCETR-UWVGGRQHSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) MetaboLights (MTBLS90)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
human blood serum metabolite  Any metabolite (endogenous or exogenous) found in human blood serum samples.
ChEBI Ontology
Outgoing Relation(s)
Asp-Phe (CHEBI:73830) has role human blood serum metabolite (CHEBI:85234)
Asp-Phe (CHEBI:73830) has role human xenobiotic metabolite (CHEBI:76967)
Asp-Phe (CHEBI:73830) is a dipeptide (CHEBI:46761)
IUPAC Name 
L-α-aspartyl-L-phenylalanine
Synonyms  Source
α-aspartylphenylalanineChEBI
aspartylphenylalanineChEBI
L-α-Asp-L-PheChEBI
DFChEBI
L-Asp-L-PheChEBI
Aspartyl-phenylalanineChemIDplus
Manual XrefsDatabases
HMDB0000706HMDB
Registry NumbersSources
Reaxys:2817528Reaxys
CAS:13433-09-5ChemIDplus
Citations