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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N3-oxalyl-L-2,3-diaminopropionic acid
ChEBI ID CHEBI:16399
ChEBI ASCII Name N(3)-oxalyl-L-2,3-diaminopropionic acid
Definition An Nβ-acyl-L-2,3-diaminopropionic acid in which the acyl group is oxalyl.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:21830, CHEBI:21223, CHEBI:21829, CHEBI:12640, CHEBI:7384
Supplier Information
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Formula C5H8N2O5
Net Charge 0
Average Mass 176.12750
Monoisotopic Mass 176.04332
InChI InChI=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
InChIKey NEEQFPMRODQIKX-REOHCLBHSA-N
SMILES N[C@@H](CNC(=O)C(O)=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 N3-(carboxylatoformyl)-L-2,3-diaminopropionate(1−) (CHEBI:57758) is conjugate base of N3-oxalyl-L-2,3-diaminopropionic acid (CHEBI:16399)
IUPAC Names
(2S)-2-amino-3-[(carboxycarbonyl)amino]propanoic acid
3-[(carboxycarbonyl)amino]-L-alanine
Synonyms Sources
(2-Amino-2-carboxyethyl)-L-oxamic acid ChemIDplus
3-N-Oxalyl-L-2,3-diaminopropanoic acid ChemIDplus
beta-N-Oxalyl-L-alpha,beta-diaminopropionic acid ChemIDplus
beta-N-Oxalylamino-L-alanine ChemIDplus
L-alpha-Amino-beta-oxalylaminopropionic acid KEGG COMPOUND
L-Dencichin ChemIDplus
N3-Oxalyl-L-2,3-diaminopropanoate KEGG COMPOUND
Manual Xrefs Databases
C00001339 KNApSAcK
C04209 KEGG COMPOUND
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Registry Numbers Types Sources
5302-45-4 CAS Registry Number KEGG COMPOUND
5302-45-4 CAS Registry Number ChemIDplus
Last Modified
28 July 2014