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CHEBI:4906 - etidronate disodium

ChEBI IDCHEBI:4906
ChEBI Nameetidronate disodium
Stars
DefinitionAn organic sodium salt resulting from the replacement of two protons from etidronic acid (one from from each of the phosphonic acid groups) by sodium ions.
Last Modified19 February 2014
DownloadsMolfile
FormulaC2H6O7P2.2Na
Net Charge0
Average Mass249.991
Monoisotopic Mass249.93841
SMILESCC(O)(P(=O)([O-])O)P(=O)([O-])O.[Na+].[Na+]
InChIInChI=1S/C2H8O7P2.2Na/c1-2(3,10(4,5)6)11(7,8)9;;/h3H,1H3,(H2,4,5,6)(H2,7,8,9);;/q;2*+1/p-2
InChIKeyGWBBVOVXJZATQQ-UHFFFAOYSA-L
Roles Classification
Chemical Role:
chelator  A ligand with two or more separate binding sites that can bind to a single metallic central atom, forming a chelate.
Applications:
bone density conservation agent  An agent that inhibits bone resorption and/or favor bone mineralization and bone regeneration. Used to heal bone fractures and to treat bone diseases such as osteopenia and osteoporosis.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
etidronate disodium (CHEBI:4906) has part etidronic acid(2−) (CHEBI:77356)
etidronate disodium (CHEBI:4906) has role antineoplastic agent (CHEBI:35610)
etidronate disodium (CHEBI:4906) has role bone density conservation agent (CHEBI:50646)
etidronate disodium (CHEBI:4906) has role chelator (CHEBI:38161)
etidronate disodium (CHEBI:4906) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
disodium (1-hydroxyethane-1,1-diyl)bis[hydrogen (phosphonate)]
Synonyms  Source
disodium etidronateChemIDplus
disodium 1-hydroxyethylidene phosphonateChemIDplus
sodium ethydronateChemIDplus
sodium etidronateChemIDplus
(1-hydroxyethylidene)diphosphonic acid, disodium saltChemIDplus
1-hydroxyethylidene-1,1-diphosphonic acid disodium saltChemIDplus
Brand Name  Source
DidronelKEGG DRUG
Manual XrefsDatabases
D00314KEGG DRUG
DB01077DrugBank
HMDB0015210HMDB
Registry NumbersSources
Reaxys:5190835Reaxys
CAS:7414-83-7ChemIDplus
Citations