Terminology Service for NFDI4Health
diclofenac
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http://purl.obolibrary.org/obo/CHEBI_47381
A monocarboxylic acid consisting of phenylacetic acid having a (2,6-dichlorophenyl)amino group at the 2-position.
Term info
Label
diclofenac
Synonyms
- 2-[(2,6-dichlorophenyl)amino]benzeneacetic acid
- Diclofenac
- {2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid
Subsets
3_STAR
charge
0
formula
C14H11Cl2NO2
has alternative id
CHEBI:4507, CHEBI:47380
has obo namespace
chebi_ontology
has related synonym
diclofenaco, diclofenacum, [2-(2,6-dichloroanilino)phenyl]acetic acid, 2-((2,6-dichlorophenyl)amino)benzeneacetic acid, diclofenac acid, diclofenac, diclofenamic acid
id
CHEBI:47381
inchi
InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
inchikey
DCOPUUMXTXDBNB-UHFFFAOYSA-N
mass
296.150
monoisotopicmass
295.01668
smiles
C1(Cl)=CC=CC(=C1NC2=CC=CC=C2CC(=O)O)Cl
Term relations
Subclass of:
- dichlorobenzene
- secondary amino compound
- amino acid
- monocarboxylic acid
- aromatic amine
- has role some antipyretic
- has role some non-narcotic analgesic
- has role some xenobiotic
- has role some drug allergen
- has functional parent some phenylacetic acid
- has role some environmental contaminant
- has functional parent some diphenylamine
- has role some non-steroidal anti-inflammatory drug
- has role some EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor
- is conjugate acid of some diclofenac(1-)
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