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CHEBI:76269 - robenacoxib

ChEBI IDCHEBI:76269
ChEBI Namerobenacoxib
Stars
DefinitionAn aromatic amino acid that is 2-amino-5-ethylphenylacetic acid in which one of the amino hydrogens is replaced by a 2,3,5,6-tetrafluorophenyl group. A selective cyclooxygenase 2 inhibitor that is used in veterinary medicine for the relief of pain and inflammation in cats and dogs.
Last Modified23 December 2018
SubmitterSteve
DownloadsMolfile
FormulaC16H13F4NO2
Net Charge0
Average Mass327.277
Monoisotopic Mass327.08824
SMILESCCc1ccc(Nc2c(F)c(F)cc(F)c2F)c(CC(=O)O)c1
InChIInChI=1S/C16H13F4NO2/c1-2-8-3-4-12(9(5-8)6-13(22)23)21-16-14(19)10(17)7-11(18)15(16)20/h3-5,7,21H,2,6H2,1H3,(H,22,23)
InChIKeyZEXGDYFACFXQPF-UHFFFAOYSA-N
Wikipedia
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:
cyclooxygenase 2 inhibitor  A cyclooxygenase inhibitor that interferes with the action of cyclooxygenase 2.
non-narcotic analgesic  A drug that has principally analgesic, antipyretic and anti-inflammatory actions. Non-narcotic analgesics do not bind to opioid receptors.
Applications:
non-narcotic analgesic  A drug that has principally analgesic, antipyretic and anti-inflammatory actions. Non-narcotic analgesics do not bind to opioid receptors.
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)
robenacoxib (CHEBI:76269) has role cyclooxygenase 2 inhibitor (CHEBI:50629)
robenacoxib (CHEBI:76269) has role non-narcotic analgesic (CHEBI:35481)
robenacoxib (CHEBI:76269) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
robenacoxib (CHEBI:76269) is a aromatic amino acid (CHEBI:33856)
robenacoxib (CHEBI:76269) is a monocarboxylic acid (CHEBI:25384)
robenacoxib (CHEBI:76269) is a organofluorine compound (CHEBI:37143)
robenacoxib (CHEBI:76269) is a phenylacetic acids (CHEBI:25978)
robenacoxib (CHEBI:76269) is a secondary amino compound (CHEBI:50995)
IUPAC Name 
{5-ethyl-2-[(2,3,5,6-tetrafluorophenyl)amino]phenyl}acetic acid
INNs  Source
robenacoxibChemIDplus
robenacoxibumWHO MedNet
robénacoxibWHO MedNet
robenacoxibWHO MedNet
Manual XrefsDatabases
US6291523Patent
RobenacoxibWikipedia
3002VSDB
Registry NumbersSources
Reaxys:13748212Reaxys
CAS:220991-32-2ChemIDplus
Citations