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CHEBI:169989 - 3-Phenoxypropionic acid

ChEBI IDCHEBI:169989
ChEBI Name3-Phenoxypropionic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H10O3
Net Charge0
Average Mass166.176
Monoisotopic Mass166.06299
SMILESO=C(O)CCOc1ccccc1
InChIInChI=1S/C9H10O3/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)
InChIKeyBUSOTUQRURCMCM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus Musculus (ncbitaxon:10090)
blood plasma (BTO:0000131) MetaboLights (MTBLS1903) Strain: C57BL/6N Mouse [THESAURUS.OWL#C37385]
liver (BTO:0000759) MetaboLights (MTBLS1903) Strain: C57BL/6N Mouse [THESAURUS.OWL#C37385]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-Phenoxypropionic acid (CHEBI:169989) is a aromatic ether (CHEBI:35618)
3-Phenoxypropionic acid (CHEBI:169989) is a carboxylic acid (CHEBI:33575)
IUPAC Name 
3-phenoxypropanoic acid
Manual XrefsDatabases
HMDB0002229HMDB
73626ChemSpider
Registry NumbersSources
CAS:7170-38-9ChemIDplus