CHEBI:6128 - ketoprofen

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ChEBI Name ketoprofen
ChEBI ID CHEBI:6128
Definition An oxo monocarboxylic acid that consists of propionic acid substituted by a 3-benzoylphenyl group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C16H14O3
Net Charge 0
Average Mass 254.28056
Monoisotopic Mass 254.094
InChI InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)
InChIKey DKYWVDODHFEZIM-UHFFFAOYSA-N
SMILES CC(C(O)=O)c1cccc(c1)C(=O)c1ccccc1
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): 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.
xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application(s): 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.
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.
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ChEBI Ontology
Outgoing ketoprofen (CHEBI:6128) has functional parent propionic acid (CHEBI:30768)
ketoprofen (CHEBI:6128) has role antipyretic (CHEBI:35493)
ketoprofen (CHEBI:6128) has role EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor (CHEBI:35544)
ketoprofen (CHEBI:6128) has role environmental contaminant (CHEBI:78298)
ketoprofen (CHEBI:6128) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
ketoprofen (CHEBI:6128) has role xenobiotic (CHEBI:35703)
ketoprofen (CHEBI:6128) is a benzophenones (CHEBI:22726)
ketoprofen (CHEBI:6128) is a oxo monocarboxylic acid (CHEBI:35871)
IUPAC Name
2-(3-benzoylphenyl)propanoic acid
Synonyms Sources
2-(3-Benzoylphenyl)propionic acid ChemIDplus
3-Benzoyl-α-methylbenzeneacetic acid NIST Chemistry WebBook
3-Benzoylhydratropic acid ChemIDplus
Ketoprofen KEGG COMPOUND
L'Acide (benzoyl-3-phenyl)-2-propionique NIST Chemistry WebBook
m-Benzoylhydratropic acid ChemIDplus
Orudis (TN) KEGG DRUG
Database Links Databases
1528 DrugCentral
C01716 KEGG COMPOUND
D00132 KEGG DRUG
DB01009 DrugBank
HMDB0015144 HMDB
Ketoprofen Wikipedia
LSM-1955 LINCS
View more database links
Registry Numbers Types Sources
22071-15-4 CAS Registry Number KEGG COMPOUND
22071-15-4 CAS Registry Number ChemIDplus
22071-15-4 CAS Registry Number NIST Chemistry WebBook
2216071 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11452775 PubMed citation Europe PMC
12772856 PubMed citation Europe PMC
18969772 PubMed citation Europe PMC
Last Modified
22 February 2017