EDTA monocalcium diisodium salt (CHEBI:4757)

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ChEBI Name	EDTA monocalcium diisodium salt

ChEBI ID	CHEBI:4757

Definition	An organic calcium salt of EDTA diisodium. It is a chelating agent that is used for the treatment of lead poisoning.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ChemicalBook:CB62562887, ChemicalBook:CB7231230, ChemicalBook:CB6781152, eMolecules:5753632, eMolecules:6884114

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Wikipedia	License
Sodium calcium edetate (sodium calcium EDTA), also known as edetate calcium disodium among other names, is a medication primarily used to treat lead poisoning, including both short-term and long-term lead poisoning. Sodium calcium edetate came into medical use in the United States in 1953.
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Formulae

C10H12CaN2Na2O8
C10H12CaN2O8.2Na
C10H12N2O8.Ca.Na.Na

Net Charge

Average Mass

374.270

Monoisotopic Mass

374.00149

InChI

InChI=1S/C10H16N2O8.Ca.2Na/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);;;/q;+2;2*+1/p-4

InChIKey

SHWNNYZBHZIQQV-UHFFFAOYSA-J

SMILES

[Na+].[Na+].[Ca++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O

Roles Classification
Chemical Role(s):	chelator A ligand with two or more separate binding sites that can bind to a single metallic central atom, forming a chelate.

Application(s):	geroprotector Any compound that supports healthy aging, slows the biological aging process, or extends lifespan. antidote Any protective agent counteracting or neutralizing the action of poisons.

ChEBI Ontology
Outgoing	EDTA monocalcium diisodium salt (CHEBI:4757) has part EDTA disodium salt (anhydrous) (CHEBI:64734) EDTA monocalcium diisodium salt (CHEBI:4757) has role antidote (CHEBI:50247) EDTA monocalcium diisodium salt (CHEBI:4757) has role chelator (CHEBI:38161) EDTA monocalcium diisodium salt (CHEBI:4757) has role geroprotector (CHEBI:176497) EDTA monocalcium diisodium salt (CHEBI:4757) is a organic calcium salt (CHEBI:51031)

IUPAC Names

calcium disodium 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate

calcium sodium 2,2',2'',2'''-(ethane-1,2-diyldinitrilo)tetraacetate (1:2:1)

Synonyms	Sources
CaEDTA	ChEBI
calcium disodium edetate	ChemIDplus
calcium disodium EDTA	ChemIDplus
calcium disodium ethylenediamine tetraacetic acid	ChemIDplus
calcium disodium ethylenediaminetetraacetate	ChemIDplus
calcium EDTA	ChemIDplus
calcium sodium 2,2',2'',2'''-(ethane-1,2-diyldinitrilo)tetraacetate (1/2/1)	IUPAC
calcium sodium EDTA	ChemIDplus
CaNa₂EDTA	ChEBI
disodium calcium EDTA	ChemIDplus
disodium calcium ethylenediaminetetraacetate	ChemIDplus
disodium monocalcium EDTA	ChemIDplus
edetate calcium disodium	ChemIDplus
edetate calcium disodium (anhydrous)	ChemIDplus
EDTA calcium disodium salt	ChemIDplus
EDTA disodium calcium salt	ChemIDplus
EDTA, calcium derivative, disodium salt	KEGG COMPOUND
ethylenediaminetetraacetic acid calcium disodium salt	ChemIDplus
monocalcium disodium EDTA	ChemIDplus

Registry Number	Type	Source
62-33-9	CAS Registry Number	ChemIDplus

Citations

Last Modified

22 September 2021