CHEBI:76200 - clonixin

ChEBI IDCHEBI:76200
ChEBI Nameclonixin
Stars
DefinitionA pyridinemonocarboxylic acid that is nicotinic acid substituted at position 2 by a (2-methyl-3-chlorophenyl)amino group. Used (as its lysine salt) for treatment of renal colic, muscular pain and moderately severe migraine attacks.
Last Modified22 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC13H11ClN2O2
Net Charge0
Average Mass262.696
Monoisotopic Mass262.05091
SMILESCc1c(Cl)cccc1Nc1ncccc1C(=O)O
InChIInChI=1S/C13H11ClN2O2/c1-8-10(14)5-2-6-11(8)16-12-9(13(17)18)4-3-7-15-12/h2-7H,1H3,(H,15,16)(H,17,18)
InChIKeyCLOMYZFHNHFSIQ-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
lipoxygenase inhibitor  A compound or agent that combines with lipoxygenase and thereby prevents its substrate-enzyme combination with arachidonic acid and the formation of the icosanoid products hydroxyicosatetraenoic acid and various leukotrienes.
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor  A compound or agent that combines with cyclooxygenases (EC 1.14.99.1) and thereby prevents its substrate-enzyme combination with arachidonic acid and the formation of icosanoids, prostaglandins, and thromboxanes.
non-narcotic analgesic  A drug that has principally analgesic, antipyretic and anti-inflammatory actions. Non-narcotic analgesics do not bind to opioid receptors.
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.
vasodilator agent  A drug used to cause dilation of the blood vessels.
platelet aggregation inhibitor  A drug or agent which antagonizes or impairs any mechanism leading to blood platelet aggregation, whether during the phases of activation and shape change or following the dense-granule release reaction and stimulation of the prostaglandin-thromboxane system.
non-narcotic analgesic  A drug that has principally analgesic, antipyretic and anti-inflammatory actions. Non-narcotic analgesics do not bind to opioid receptors.
ChEBI Ontology
Outgoing Relation(s)
clonixin (CHEBI:76200) has functional parent nicotinic acid (CHEBI:15940)
clonixin (CHEBI:76200) has role antipyretic (CHEBI:35493)
clonixin (CHEBI:76200) has role EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor (CHEBI:35544)
clonixin (CHEBI:76200) has role lipoxygenase inhibitor (CHEBI:35856)
clonixin (CHEBI:76200) has role non-narcotic analgesic (CHEBI:35481)
clonixin (CHEBI:76200) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
clonixin (CHEBI:76200) has role platelet aggregation inhibitor (CHEBI:50427)
clonixin (CHEBI:76200) has role vasodilator agent (CHEBI:35620)
clonixin (CHEBI:76200) is a aminopyridine (CHEBI:38207)
clonixin (CHEBI:76200) is a organochlorine compound (CHEBI:36683)
clonixin (CHEBI:76200) is a pyridinemonocarboxylic acid (CHEBI:26420)
clonixin (CHEBI:76200) is conjugate acid of clonixin(1−) (CHEBI:76203)
Incoming Relation(s)
clonixin(1−) (CHEBI:76203) is conjugate base of clonixin (CHEBI:76200)
IUPAC Name 
2-[(3-chloro-2-methylphenyl)amino]nicotinic acid
INNs  Source
clonixinKEGG DRUG
clonixinoChemIDplus
clonixinumChemIDplus
clonixineChemIDplus
Synonyms  Source
2-(3-Chloro-2-methylanilino)nicotinic acidChemIDplus
CBA 93626ChemIDplus
2-(2'-Methyl-3'-chloro)anilinonicotinic acidChemIDplus
2-(3-Chloro-o-toluidino)nicotinic acidChemIDplus
Clonixic acidChemIDplus
Sch 10304ChemIDplus
Manual XrefsDatabases
D03555KEGG DRUG
US2008014272Patent
US2005163847Patent
705DrugCentral
Registry NumbersSources
Reaxys:483212Reaxys
CAS:17737-65-4KEGG DRUG
CAS:17737-65-4ChemIDplus
Citations