CHEBI:48427 - N-formimidoyl-L-aspartic acid

ChEBI IDCHEBI:48427
ChEBI NameN-formimidoyl-L-aspartic acid
Stars
ASCII NameN-formimidoyl-L-aspartic acid
DefinitionAn aspartic acid derivative that is the N-formimidoyl derivative of L-aspartic acid.
Secondary ChEBI IDsCHEBI:7273, CHEBI:21703
Last Modified9 December 2024
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC5H8N2O4
Net Charge0
Average Mass160.129
Monoisotopic Mass160.04841
SMILES[H]C(=N)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C5H8N2O4/c6-2-7-3(5(10)11)1-4(8)9/h2-3H,1H2,(H2,6,7)(H,8,9)(H,10,11)/t3-/m0/s1
InChIKeyXTPIFIMCFHNJOH-VKHMYHEASA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
N-formimidoyl-L-aspartic acid (CHEBI:48427) has role bacterial xenobiotic metabolite (CHEBI:76976)
N-formimidoyl-L-aspartic acid (CHEBI:48427) is a L-aspartic acid derivative (CHEBI:83978)
N-formimidoyl-L-aspartic acid (CHEBI:48427) is a C4-dicarboxylic acid (CHEBI:66873)
N-formimidoyl-L-aspartic acid (CHEBI:48427) is conjugate acid of N-formimidoyl-L-aspartate(2−) (CHEBI:18387)
N-formimidoyl-L-aspartic acid (CHEBI:48427) is conjugate acid of N-iminiumylmethyl-L-aspartate (CHEBI:58748)
Incoming Relation(s)
N-formimidoyl-L-aspartate(2−) (CHEBI:18387) is conjugate base of N-formimidoyl-L-aspartic acid (CHEBI:48427)
N-iminiumylmethyl-L-aspartate (CHEBI:58748) is conjugate base of N-formimidoyl-L-aspartic acid (CHEBI:48427)
IUPAC Names 
(2S)-2-(methanimidamido)butanedioic acid
N-methanimidoyl-L-aspartic acid
Synonyms  Source
N-Formimidoyl-L-aspartateKEGG COMPOUND
N-Formimino-L-aspartateKEGG COMPOUND
Manual XrefsDatabases
C03409KEGG COMPOUND
NFQPDBeChem
Registry NumbersSources
Reaxys:1708868Reaxys
Citations