CHEBI:167786 - 4-(4-ethoxyphenyl)-4-oxobutanoic acid

ChEBI IDCHEBI:167786
ChEBI Name4-(4-ethoxyphenyl)-4-oxobutanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O4
Net Charge0
Average Mass222.240
Monoisotopic Mass222.08921
SMILESCCOc1ccc(C(=O)CCC(=O)O)cc1
InChIInChI=1S/C12H14O4/c1-2-16-10-5-3-9(4-6-10)11(13)7-8-12(14)15/h3-6H,2,7-8H2,1H3,(H,14,15)
InChIKeyHXMFVOXVXQBEEJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) MetaboLights (MTBLS2542)
ChEBI Ontology
Outgoing Relation(s)
4-(4-ethoxyphenyl)-4-oxobutanoic acid (CHEBI:167786) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
4-(4-ethoxyphenyl)-4-oxobutanoic acid
Manual XrefsDatabases
633651ChemSpider