clodronic acid disodium salt (CHEBI:59586)

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CHEBI:59586 - clodronic acid disodium salt

ChEBI ID	CHEBI:59586
ChEBI Name	clodronic acid disodium salt
Stars
Definition	The disodium salt of clodronic acid. It inhibits bone resorption and soft tissue calcification, and is used (generally as the tetrahydrate) as an adjunct in the treatment of severe hypercalcaemia associated with malignancy, and in the management of osteolytic lesions and bone pain associated with skeletal metastases.
Last Modified	12 June 2012
Submitter	Gareth Owen
Downloads	Molfile

Formula	CH2Cl2O6P2.2Na
Net Charge	0
Average Mass	288.855
Monoisotopic Mass	287.84990
SMILES	O=P([O-])(O)C(Cl)(Cl)P(=O)([O-])O.[Na+].[Na+]
InChI	InChI=1S/CH4Cl2O6P2.2Na/c2-1(3,10(4,5)6)11(7,8)9;;/h(H2,4,5,6)(H2,7,8,9);;/q;2*+1/p-2
InChIKey	HJKBJIYDJLVSAO-UHFFFAOYSA-L

Roles Classification

Biological Role:

analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.

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)
	clodronic acid disodium salt (CHEBI:59586) has part clondronate(2−) (CHEBI:59585)
	clodronic acid disodium salt (CHEBI:59586) has role analgesic (CHEBI:35480)
	clodronic acid disodium salt (CHEBI:59586) has role antineoplastic agent (CHEBI:35610)
	clodronic acid disodium salt (CHEBI:59586) has role bone density conservation agent (CHEBI:50646)
	clodronic acid disodium salt (CHEBI:59586) is a 1,1-bis(phosphonic acid) (CHEBI:77383)
	clodronic acid disodium salt (CHEBI:59586) is a one-carbon compound (CHEBI:64708)
	clodronic acid disodium salt (CHEBI:59586) is a organic molecular entity (CHEBI:50860)
	clodronic acid disodium salt (CHEBI:59586) is a organic sodium salt (CHEBI:38700)
Incoming Relation(s)
Incoming Relation(s)	disodium clodronate tetrahydrate (CHEBI:59587) has part clodronic acid disodium salt (CHEBI:59586)

IUPAC Name
disodium (dichloromethanediyl)bis[hydrogen (phosphonate)]

Synonyms	Source
177501	ChEMBL
clodronate disodium	ChEMBL
clodronate disodium	KEGG DRUG
Clodronate disodium anhydrous	ChEMBL
clodronate sodium	ChemIDplus
clodronic acid disodium salt	KEGG DRUG

Brand Name	Source
Bonefos	ChEMBL

Manual Xrefs	Databases
D07720	KEGG DRUG

Registry Numbers	Sources
Beilstein:5841154	Beilstein
CAS:22560-50-5	KEGG DRUG
CAS:22560-50-5	ChemIDplus

Citations