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CHEBI:219802 - 2-[2-[(2-carboxyacetyl)amino]propanoylamino]benzoic acid

ChEBI IDCHEBI:219802
ChEBI Name2-[2-[(2-carboxyacetyl)amino]propanoylamino]benzoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14N2O6
Net Charge0
Average Mass294.263
Monoisotopic Mass294.08519
SMILESC[C@H](NC(=O)CC(=O)O)C(=O)Nc1ccccc1C(=O)O
InChIInChI=1S/C13H14N2O6/c1-7(14-10(16)6-11(17)18)12(19)15-9-5-3-2-4-8(9)13(20)21/h2-5,7H,6H2,1H3,(H,14,16)(H,15,19)(H,17,18)(H,20,21)/t7-/m0/s1
InChIKeyLCKFAMIWUNBCPL-ZETCQYMHSA-N
Species of MetaboliteComponentSourceComments
Penicillium chrysogenum (ncbitaxon:5076) - PubMed (29196288)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[2-[(2-carboxyacetyl)amino]propanoylamino]benzoic acid (CHEBI:219802) is a amidobenzoic acid (CHEBI:48470)
IUPAC Name 
2-[2-[(2-carboxyacetyl)amino]propanoylamino]benzoic acid