CHEBI:132232 - ethylenediaminetriacetic acid

ChEBI IDCHEBI:132232
ChEBI Nameethylenediaminetriacetic acid
Stars
DefinitionAn ethylenediamine derivative in which three of the four amine protons of ethylenediamine are replaced by carboxymethyl groups.
Last Modified20 June 2016
SubmitterSteve
DownloadsMolfile
FormulaC8H14N2O6
Net Charge0
Average Mass234.208
Monoisotopic Mass234.08519
SMILESO=C(O)CNCCN(CC(=O)O)CC(=O)O
InChIInChI=1S/C8H14N2O6/c11-6(12)3-9-1-2-10(4-7(13)14)5-8(15)16/h9H,1-5H2,(H,11,12)(H,13,14)(H,15,16)
InChIKeyOUDSFQBUEBFSPS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Agrobacterium sp. (ncbitaxon:361) - PubMed (11157232) Strain: ATCC 55002
Roles Classification
Chemical Roles:
chelator  A ligand with two or more separate binding sites that can bind to a single metallic central atom, forming a chelate.
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).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
ethylenediaminetriacetic acid (CHEBI:132232) has role bacterial xenobiotic metabolite (CHEBI:76976)
ethylenediaminetriacetic acid (CHEBI:132232) has role chelator (CHEBI:38161)
ethylenediaminetriacetic acid (CHEBI:132232) is a ethylenediamine derivative (CHEBI:31577)
ethylenediaminetriacetic acid (CHEBI:132232) is a glycine derivative (CHEBI:24373)
ethylenediaminetriacetic acid (CHEBI:132232) is a polyamino carboxylic acid (CHEBI:60892)
ethylenediaminetriacetic acid (CHEBI:132232) is a tricarboxylic acid (CHEBI:27093)
ethylenediaminetriacetic acid (CHEBI:132232) is conjugate acid of ethylenediaminetriacetate(2−) (CHEBI:131921)
Incoming Relation(s)
ethylenediaminetriacetate(2−) (CHEBI:131921) is conjugate base of ethylenediaminetriacetic acid (CHEBI:132232)
IUPAC Name 
N-{2-[bis(carboxymethyl)amino]ethyl}glycine
Synonyms  Source
N-(Carboxymethyl)-N-(2-((carboxymethyl)amino)ethyl)glycineChemIDplus
ethylenediamine-N,N,N'-triacetic acidChEBI
Manual XrefsDatabases
CPD-18914MetaCyc
Registry NumbersSources
Reaxys:2378200Reaxys
CAS:688-57-3ChemIDplus
Citations