CHEBI:64706 - decarboxytiaprofenic acid

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ChEBI Name decarboxytiaprofenic acid
ChEBI ID CHEBI:64706
Definition A thiophene substituted at C-2 by benzoyl and at C-4 by an ethyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C13H12OS
Net Charge 0
Average Mass 216.29900
Monoisotopic Mass 216.06089
InChI InChI=1S/C13H12OS/c1-2-11-8-9-12(15-11)13(14)10-6-4-3-5-7-10/h3-9H,2H2,1H3
InChIKey KRUFIFKRFHMKHL-UHFFFAOYSA-N
SMILES CCc1ccc(s1)C(=O)c1ccccc1
Roles Classification
Biological Role(s): epitope
The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
Application(s): photosensitizing agent
A chemical compound that can be excited by light of a specific wavelength and subsequently transfer energy to a chosen reactant. This is commonly molecular oxygen within a cancer tissue, which is converted to (highly rective) singlet state oxygen. This rapidly reacts with any nearby biomolecules, ultimately killing the cancer cells.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing decarboxytiaprofenic acid (CHEBI:64706) has role epitope (CHEBI:53000)
decarboxytiaprofenic acid (CHEBI:64706) has role photosensitizing agent (CHEBI:47868)
decarboxytiaprofenic acid (CHEBI:64706) is a aromatic ketone (CHEBI:76224)
decarboxytiaprofenic acid (CHEBI:64706) is a thiophenes (CHEBI:26961)
IUPAC Name
(5-ethyl-2-thienyl)(phenyl)methanone
Synonym Source
5-ethyl-2-benzoylthiophene ChEBI
Registry Number Type Source
151561 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11195850 PubMed citation Europe PMC
11332030 PubMed citation Europe PMC
11712905 PubMed citation Europe PMC
20650119 PubMed citation Europe PMC
7870764 PubMed citation Europe PMC
9337613 PubMed citation Europe PMC
Last Modified
07 November 2013