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CHEBI:168088 - N-Carboxyacetyl-D-phenylalanine

ChEBI IDCHEBI:168088
ChEBI NameN-Carboxyacetyl-D-phenylalanine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H13NO5
Net Charge0
Average Mass251.238
Monoisotopic Mass251.07937
SMILESO=C(O)CC(=O)NC(Cc1ccccc1)C(=O)O
InChIInChI=1S/C12H13NO5/c14-10(7-11(15)16)13-9(12(17)18)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,14)(H,15,16)(H,17,18)
InChIKeyIHAMOIOWKITHQZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
N-Carboxyacetyl-D-phenylalanine (CHEBI:168088) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name 
2-[(2-carboxyacetyl)amino]-3-phenylpropanoic acid
Manual XrefsDatabases
13634418ChemSpider
HMDB0039102HMDB