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CHEBI:49010 - aspartic 1-amide

ChEBI IDCHEBI:49010
ChEBI Nameaspartic 1-amide
Stars
Last Modified3 December 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC4H8N2O3
Net Charge0
Average Mass132.119
Monoisotopic Mass132.05349
SMILESNC(=O)C(N)CC(=O)O
InChIInChI=1S/C4H8N2O3/c5-2(4(6)9)1-3(7)8/h2H,1,5H2,(H2,6,9)(H,7,8)
InChIKeyPMLJIHNCYNOQEQ-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
aspartic 1-amide (CHEBI:49010) is a amino acid amide (CHEBI:22475)
aspartic 1-amide (CHEBI:49010) is a aspartic acid derivative (CHEBI:22661)
aspartic 1-amide (CHEBI:49010) is a β-amino acid (CHEBI:33706)
Incoming Relation(s)
D-aspartic 1-amide (CHEBI:49011) is a aspartic 1-amide (CHEBI:49010)
L-aspartic 1-amide (CHEBI:21248) is a aspartic 1-amide (CHEBI:49010)
IUPAC Names 
aspartic 1-amide
3,4-diamino-4-oxobutanoic acid
Synonyms  Source
isoasparagineChemIDplus
DL-isoasparagineChemIDplus
DL-α-asparagineChemIDplus
3-aminosuccinamic acidChemIDplus
α-asparagineChEBI
aspartic acid 1-amideChEBI
Registry NumbersSources
Beilstein:1723519Beilstein
CAS:498-25-9ChemIDplus