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CHEBI:756122 - edetate calcium disodium monohydrate

Default Structure
ChEBI IDCHEBI:756122
ChEBI Nameedetate calcium disodium monohydrate
Stars
Last Modified29 June 2026
Submitterchembl-etl
DownloadsMolfile
FormulaH2O.C10H12N2O8.Ca.Na.Na
Net Charge0
Average Mass392.285
Monoisotopic Mass392.01206
SMILESO.O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Ca+2].[Na+].[Na+]
InChIInChI=1S/C10H16N2O8.Ca.2Na.H2O/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);;;;1H2/q;+2;2*+1;/p-4
InChIKeyJHECKPXUCKQCSH-UHFFFAOYSA-J
Roles Classification
Application:
antidote  Any protective agent counteracting or neutralizing the action of poisons.
ChEBI Ontology
Outgoing Relation(s)
edetate calcium disodium monohydrate (CHEBI:756122) has functional parent tetracarboxylic acid (CHEBI:35742)
edetate calcium disodium monohydrate (CHEBI:756122) has role antidote (CHEBI:50247)
edetate calcium disodium monohydrate (CHEBI:756122) is a organooxygen compound (CHEBI:36963)
Synonyms  Source
Calcium disodium edta dihydrateChEMBL
Calcium sodium edetate hydrateChEMBL
Edetate calcium disodium monohydrateChEMBL
Brand Names  Source
Calcium disodium versenateChEMBL
LedclairChEMBL