CHEBI:90074 - 4-Ethylbenzoic acid

ChEBI IDCHEBI:90074
ChEBI Name4-Ethylbenzoic acid
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DownloadsMolfile
FormulaC9H10O2
Net Charge0
Average Mass150.177
Monoisotopic Mass150.06808
SMILESCCc1ccc(C(=O)O)cc1
InChIInChI=1S/C9H10O2/c1-2-7-3-5-8(6-4-7)9(10)11/h3-6H,2H2,1H3,(H,10,11)
InChIKeyZQVKTHRQIXSMGY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
urine (BTO:0001419) PubMed (19812218)
blood (UBERON:0000178) PubMed (19812218)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-Ethylbenzoic acid (CHEBI:90074) is a benzoic acids (CHEBI:22723)
Synonyms  Source
4-EthylbenzoateHMDB
4-Ethyl Benzoic acidHMDB
4-Ethyl BenzoateHMDB
p-Ethylbenzoic acidHMDB
4-ethylbenzoic acidHMDB
p-EthylbenzoateHMDB
Manual XrefsDatabases
HMDB0002097HMDB
Registry NumbersSources
CAS:619-64-7KEGG COMPOUND
Citations