CHEBI:31597 - biphenyl-4-ylacetic acid

ChEBI IDCHEBI:31597
ChEBI Namebiphenyl-4-ylacetic acid
Stars
DefinitionA monocarboxylic acid in which one of the α-hydrogens is substituted by a biphenyl-4-yl group. An active metabolite of fenbufen, it is used as a topical medicine to treat muscle inflammation and arthritis.
Last Modified12 June 2017
DownloadsMolfile
FormulaC14H12O2
Net Charge0
Average Mass212.248
Monoisotopic Mass212.08373
SMILESO=C(O)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C14H12O2/c15-14(16)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,16)
InChIKeyQRZAKQDHEVVFRX-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Application:
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)
biphenyl-4-ylacetic acid (CHEBI:31597) has functional parent acetic acid (CHEBI:15366)
biphenyl-4-ylacetic acid (CHEBI:31597) has part biphenyl-4-yl group (CHEBI:35447)
biphenyl-4-ylacetic acid (CHEBI:31597) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
biphenyl-4-ylacetic acid (CHEBI:31597) is a biphenyls (CHEBI:22888)
biphenyl-4-ylacetic acid (CHEBI:31597) is a monocarboxylic acid (CHEBI:25384)
Incoming Relation(s)
difenpiramide (CHEBI:76130) has functional parent biphenyl-4-ylacetic acid (CHEBI:31597)
IUPAC Name 
[1,1'-biphenyl]-4-ylacetic acid
INN  Source
felbinacChemIDplus
Synonyms  Source
4-biphenylacetic acidChemIDplus
4-biphenylylacetic acidChemIDplus
4-carboxymethylbiphenylChemIDplus
DolinacChemIDplus
p-biphenylylacetic acidChemIDplus
FelbinacChemIDplus
Manual XrefsDatabases
1141DrugCentral
D01675KEGG DRUG
FelbinacWikipedia
LSM-5965LINCS
Registry NumbersSources
Reaxys:1211592Reaxys
CAS:5728-52-9ChemIDplus
CAS:5728-52-9NIST Chemistry WebBook
Citations