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CHEBI:32221 - tiaprofenic acid

Default Structure
ChEBI IDCHEBI:32221
ChEBI Nametiaprofenic acid
Stars
DefinitionAn aromatic ketone that is thiophene substituted at C-2 by benzoyl and at C-4 by a 1-carboxyethyl group.
Secondary ChEBI IDCHEBI:417367
Last Modified7 March 2019
DownloadsMolfile
FormulaC14H12O3S
Net Charge0
Average Mass260.314
Monoisotopic Mass260.05072
SMILESCC(C(=O)O)c1ccc(C(=O)c2ccccc2)s1
InChIInChI=1S/C14H12O3S/c1-9(14(16)17)11-7-8-12(18-11)13(15)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)
InChIKeyGUHPRPJDBZHYCJ-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
drug allergen  Any drug which causes the onset of an allergic reaction.
Applications:
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.
drug allergen  Any drug which causes the onset of an allergic reaction.
ChEBI Ontology
Outgoing Relation(s)
tiaprofenic acid (CHEBI:32221) has role drug allergen (CHEBI:88188)
tiaprofenic acid (CHEBI:32221) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
tiaprofenic acid (CHEBI:32221) is a aromatic ketone (CHEBI:76224)
tiaprofenic acid (CHEBI:32221) is a monocarboxylic acid (CHEBI:25384)
tiaprofenic acid (CHEBI:32221) is a thiophenes (CHEBI:26961)
IUPAC Name 
2-(5-benzoylthiophen-2-yl)propanoic acid
INNs  Source
acide tiaprofeniqueChemIDplus
acido tiaprofenicoChemIDplus
acidum tiaprofenicumChemIDplus
tiaprofenic acidChemIDplus
Synonyms  Source
2-(5-Benzoyl-thiophen-2-yl)-propionic acidChEMBL
2-(5-Benzyl-2-thienyl)propionsäureChemIDplus
5-benzoyl-α-methyl-2-thiopheneacetic acidChEBI
5-benzoyl-α-methylthiophene-2-acetic acidChemIDplus
TiaprofensäureChemIDplus
α-methyl-5-benzoyl-2-thienylacetic acidChEBI
Manual XrefsDatabases
2652DrugCentral
D01325KEGG DRUG
DB01600DrugBank
DE2055264Patent
FR2112111Patent
LSM-1769LINCS
Tiaprofenic_acidWikipedia
Registry NumbersSources
Reaxys:1380662Reaxys
CAS:33005-95-7KEGG DRUG
Citations