CHEBI:17072 - N-amidino-L-aspartic acid

ChEBI IDCHEBI:17072
ChEBI NameN-amidino-L-aspartic acid
Stars
ASCII NameN-amidino-L-aspartic acid
DefinitionAn aspartic acid derivative comprising L-aspartic acid carrying an N-amidino substituent.
Secondary ChEBI IDsCHEBI:7245, CHEBI:21670
Last Modified8 June 2016
DownloadsMolfile
FormulaC5H9N3O4
Net Charge0
Average Mass175.144
Monoisotopic Mass175.05931
SMILESN=C(N)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C5H9N3O4/c6-5(7)8-2(4(11)12)1-3(9)10/h2H,1H2,(H,9,10)(H,11,12)(H4,6,7,8)/t2-/m0/s1
InChIKeyVVHOUVWJCQOYGG-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)
N-amidino-L-aspartic acid (CHEBI:17072) is a N-amidinoaspartic acid (CHEBI:90143)
N-amidino-L-aspartic acid (CHEBI:17072) is a L-aspartic acid derivative (CHEBI:83978)
N-amidino-L-aspartic acid (CHEBI:17072) is conjugate acid of N-amidino-L-aspartate(1−) (CHEBI:58005)
N-amidino-L-aspartic acid (CHEBI:17072) is conjugate acid of N-amidino-L-aspartate(2−) (CHEBI:32813)
Incoming Relation(s)
N-amidino-L-aspartate(1−) (CHEBI:58005) is conjugate base of N-amidino-L-aspartic acid (CHEBI:17072)
N-amidino-L-aspartate(2−) (CHEBI:32813) is conjugate base of N-amidino-L-aspartic acid (CHEBI:17072)
IUPAC Name 
N-carbamimidoyl-L-aspartic acid
Synonyms  Source
N-Amidino-L-aspartic acidKEGG COMPOUND
Guanidinosuccinic acidKEGG COMPOUND
N-(aminoiminomethyl)-L-aspartic acidChemIDplus
L-N-amidinoaspartic acidChemIDplus
(2S)-2-carbamimidamidobutanedioic acidIUPAC
Manual XrefsDatabases
C03139KEGG COMPOUND
C03139KEGG COMPOUND
Registry NumbersSources
Reaxys:1726856Reaxys
CAS:6133-30-8KEGG COMPOUND
CAS:6133-30-8ChemIDplus