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CHEBI:76123 - bumadizone calcium

ChEBI IDCHEBI:76123
ChEBI Namebumadizone calcium
Stars
DefinitionAn organic calcium salt having 2-[(1,2-diphenylhydrazino)carbonyl]hexanoate as the counterion. Used (as its hemihydrate) for treatment of rheumatoid arthritis.
Last Modified29 October 2013
SubmitterSteve
DownloadsMolfile
Formula2C19H21N2O3.Ca
Net Charge0
Average Mass690.854
Monoisotopic Mass690.27303
SMILESCCCCC(C(=O)[O-])C(=O)N(Nc1ccccc1)c1ccccc1.CCCCC(C(=O)[O-])C(=O)N(Nc1ccccc1)c1ccccc1.[Ca+2]
InChIInChI=1S/2C19H22N2O3.Ca/c2*1-2-3-14-17(19(23)24)18(22)21(16-12-8-5-9-13-16)20-15-10-6-4-7-11-15;/h2*4-13,17,20H,2-3,14H2,1H3,(H,23,24);/q;;+2/p-2
InChIKeyRKINNRASCJRSHD-UHFFFAOYSA-L
Wikipedia
Roles Classification
Applications:
antipyretic  A drug that prevents or reduces fever by lowering the body temperature from a raised state. An antipyretic will not affect the normal body temperature if one does not have fever. Antipyretics cause the hypothalamus to override an interleukin-induced increase in temperature. The body will then work to lower the temperature and the result is a reduction in fever.
non-steroidal anti-inflammatory drug  An anti-inflammatory drug that is not a steroid. In addition to anti-inflammatory actions, non-steroidal anti-inflammatory drugs have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins.
ChEBI Ontology
Outgoing Relation(s)
bumadizone calcium (CHEBI:76123) has part bumadizone(1−) (CHEBI:76124)
bumadizone calcium (CHEBI:76123) has role antipyretic (CHEBI:35493)
bumadizone calcium (CHEBI:76123) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
bumadizone calcium (CHEBI:76123) is a organic calcium salt (CHEBI:51031)
Incoming Relation(s)
bumadizone calcium hemihydrate (CHEBI:76122) has part bumadizone calcium (CHEBI:76123)
IUPAC Name 
calcium bis{2-[(1,2-diphenylhydrazino)carbonyl]hexanoate}
Synonyms  Source
bumadizone calcium saltChEBI
Butylmalonic acid mono(1,2-diphenylhydrazide) calciumChemIDplus
Calcium-N-n-butylmalonic acid N,N'-diphenylhydrazideChemIDplus
anhydrous bumadizone calciumChEBI
Manual XrefsDatabases
BumadizoneWikipedia
Registry NumbersSources
CAS:34461-73-9ChemIDplus
Citations