Chemical Component Summary

Name{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-CARBOXYMETHYL-AMINO}-ACETIC ACID
Identifiers2-[2-(bis(carboxymethyl)amino)ethyl-(carboxymethyl)amino]ethanoic acid
FormulaC10 H16 N2 O8
Molecular Weight292.243
TypeNON-POLYMER
Isomeric SMILESC(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
InChIInChI=1S/C10H16N2O8/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)
InChIKeyKCXVZYZYPLLWCC-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count36
Chiral Atom Count0
Bond Count35
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB00974 
NameEdetic acid
Groups
  • approved
  • vet_approved
DescriptionA chelating agent (chelating agents) that sequesters a variety of polyvalent cations. It is used in pharmaceutical manufacturing and as a food additive.
Synonyms
  • EDTA, ion(4-)
  • Edetic acid
  • Acidum edeticum
  • {[-(bis-carboxymethyl-amino)-ethyl]-carboxymethyl-amino}-acetic acid
  • Ethylenediaminetetraacetate
Brand Names
  • YIGANERJING SuifurSoap
  • Foam Care Pcmx Surgical Hand Scrub
IndicationFor the reduction of blood levels and depot stores of lead in lead poisoning (acute and chronic) and lead encephalopathy, in both pediatric populations and adults.
Categories
  • Acetates
  • Acids, Acyclic
  • Amines
  • Anticoagulants
  • Calcium Chelating Activity
CAS number60-00-4

Drug Targets

NameTarget SequencePharmacological ActionActions
Lead-unknownchelator
Iron-unknownchelator
Manganese cation-unknownchelator
Adenosine deaminaseMAQTPAFDKPKVELHVHLDGSIKPETILYYGRRRGIALPANTAEGLLNVI...unknowninhibitor
Serum paraoxonase/lactonase 3MGKLVALVLLGVGLSLVGEMFLAFRERVNASREVEPVEPENCHLIEELES...unknowninhibitor
View More
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 5232305, 6049
ChEMBL CHEMBL858
ChEBI CHEBI:42191
CCDC/CSD ZARGII, UVOGOC, UVOGIW01, UVOGIW, GAMJUZ01, GONQUX, TUGNOA, TUGNIU, MIGSIH, AQMEDA, GAMJUZ, TAFGAM, TAFFOZ, GUMYUL