CHEBI:1427 - 3-(3-hydroxyphenyl)propanoic acid

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ChEBI Name 3-(3-hydroxyphenyl)propanoic acid ChEBI ID CHEBI:1427 Definition A monocarboxylic acid that is propionic acid carrying a 3-hydroxyphenyl substituent at C-3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H10O3 Net Charge 0 Average Mass 166.17390 Monoisotopic Mass 166.06299 InChI InChI=1S/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12) InChIKey QVWAEZJXDYOKEH-UHFFFAOYSA-N SMILES OC(=O)CCc1cccc(O)c1 Metabolite of Species Details Escherichia coli (NCBI:txid562) See: PubMed Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. View more via ChEBI Ontology ChEBI Ontology Outgoing 3-(3-hydroxyphenyl)propanoic acid (CHEBI:1427) has functional parent propionic acid (CHEBI:30768) 3-(3-hydroxyphenyl)propanoic acid (CHEBI:1427) has role Escherichia coli metabolite (CHEBI:76971) 3-(3-hydroxyphenyl)propanoic acid (CHEBI:1427) has role human xenobiotic metabolite (CHEBI:76967) 3-(3-hydroxyphenyl)propanoic acid (CHEBI:1427) is a monocarboxylic acid (CHEBI:25384) 3-(3-hydroxyphenyl)propanoic acid (CHEBI:1427) is conjugate acid of 3-(3-hydroxyphenyl)propanoate (CHEBI:57277) Incoming 3-(m-hydroxyphenyl)propanoyl-CoA (CHEBI:87996) has functional parent 3-(3-hydroxyphenyl)propanoic acid (CHEBI:1427) 3-(3-hydroxyphenyl)propanoate (CHEBI:57277) is conjugate base of 3-(3-hydroxyphenyl)propanoic acid (CHEBI:1427) IUPAC Name 3-(3-hydroxyphenyl)propanoic acid Synonyms Sources 3-(3-Hydroxy-phenyl)-propanoic acid KEGG COMPOUND 3-(3-hydroxyphenyl)propionic acid NIST Chemistry WebBook 3-(m-hydroxyphenyl)propionic acid NIST Chemistry WebBook β-(m-hydroxyphenyl)propionic acid NIST Chemistry WebBook Dihydro-3-coumaric acid KEGG COMPOUND Manual Xrefs Databases 3-HYDROXYPHENYL-PROPIONATE MetaCyc C11457 KEGG COMPOUND HMDB0000375 HMDB View more database links Registry Numbers Types Sources 1947445 Reaxys Registry Number Reaxys 1947445 Beilstein Registry Number ChemIDplus 621-54-5 CAS Registry Number ChemIDplus 621-54-5 CAS Registry Number NIST Chemistry WebBook Citation Type Source 19537710 PubMed citation Europe PMC Last Modified 25 January 2016