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CHEBI:16399 - N3-oxalyl-L-2,3-diaminopropionic acid

ChEBI IDCHEBI:16399
ChEBI NameN3-oxalyl-L-2,3-diaminopropionic acid
Stars
ASCII NameN(3)-oxalyl-L-2,3-diaminopropionic acid
DefinitionAn Nβ-acyl-L-2,3-diaminopropionic acid in which the acyl group is oxalyl.
Secondary ChEBI IDsCHEBI:7384, CHEBI:12640, CHEBI:21223, CHEBI:21829, CHEBI:21830
Last Modified28 July 2014
DownloadsMolfile
FormulaC5H8N2O5
Net Charge0
Average Mass176.128
Monoisotopic Mass176.04332
SMILESN[C@@H](CNC(=O)C(=O)O)C(=O)O
InChIInChI=1S/C5H8N2O5/c6-2(4(9)10)1-7-3(8)5(11)12/h2H,1,6H2,(H,7,8)(H,9,10)(H,11,12)/t2-/m0/s1
InChIKeyNEEQFPMRODQIKX-REOHCLBHSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N3-oxalyl-L-2,3-diaminopropionic acid (CHEBI:16399) has functional parent propionic acid (CHEBI:30768)
N3-oxalyl-L-2,3-diaminopropionic acid (CHEBI:16399) is a Nβ-acyl-L-2,3-diaminopropionic acid (CHEBI:52648)
N3-oxalyl-L-2,3-diaminopropionic acid (CHEBI:16399) is conjugate acid of N3-(carboxylatoformyl)-L-2,3-diaminopropionate(1−) (CHEBI:57758)
Incoming Relation(s)
N3-(carboxylatoformyl)-L-2,3-diaminopropionate(1−) (CHEBI:57758) is conjugate base of N3-oxalyl-L-2,3-diaminopropionic acid (CHEBI:16399)
IUPAC Names 
3-[(carboxycarbonyl)amino]-L-alanine
(2S)-2-amino-3-[(carboxycarbonyl)amino]propanoic acid
Synonyms  Source
N3-Oxalyl-L-2,3-diaminopropanoateKEGG COMPOUND
L-alpha-Amino-beta-oxalylaminopropionic acidKEGG COMPOUND
3-N-Oxalyl-L-2,3-diaminopropanoic acidChemIDplus
L-DencichinChemIDplus
beta-N-Oxalyl-L-alpha,beta-diaminopropionic acidChemIDplus
beta-N-Oxalylamino-L-alanineChemIDplus
Manual XrefsDatabases
C04209KEGG COMPOUND
C00001339KNApSAcK
Registry NumbersSources
CAS:5302-45-4KEGG COMPOUND
CAS:5302-45-4ChemIDplus