CHEBI:27597 - 3-(5-hydroxyindol-3-yl)pyruvic acid

ChEBI IDCHEBI:27597
ChEBI Name3-(5-hydroxyindol-3-yl)pyruvic acid
Stars
DefinitionA hydroxyindole that is indole substituted by a 2-carboxy-2-oxoethyl group at position 2 and a hydroxy group at position 5.
Secondary ChEBI IDsCHEBI:2073, CHEBI:20587
Last Modified2 June 2023
DownloadsMolfile
FormulaC11H9NO4
Net Charge0
Average Mass219.196
Monoisotopic Mass219.05316
SMILESO=C(O)C(=O)Cc1cnc2ccc(O)cc12
InChIInChI=1S/C11H9NO4/c13-7-1-2-9-8(4-7)6(5-12-9)3-10(14)11(15)16/h1-2,4-5,12-13H,3H2,(H,15,16)
InChIKeyHKNXPMPZYQXTDD-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
ChEBI Ontology
Outgoing Relation(s)
3-(5-hydroxyindol-3-yl)pyruvic acid (CHEBI:27597) has functional parent pyruvic acid (CHEBI:32816)
3-(5-hydroxyindol-3-yl)pyruvic acid (CHEBI:27597) has role rat metabolite (CHEBI:86264)
3-(5-hydroxyindol-3-yl)pyruvic acid (CHEBI:27597) is a 2-oxo monocarboxylic acid (CHEBI:35910)
3-(5-hydroxyindol-3-yl)pyruvic acid (CHEBI:27597) is a hydroxyindoles (CHEBI:84729)
3-(5-hydroxyindol-3-yl)pyruvic acid (CHEBI:27597) is a indol-3-yl carboxylic acid (CHEBI:24810)
3-(5-hydroxyindol-3-yl)pyruvic acid (CHEBI:27597) is conjugate acid of 3-(5-hydroxyindol-3-yl)pyruvate (CHEBI:195180)
Incoming Relation(s)
3-(5-hydroxyindol-3-yl)pyruvate (CHEBI:195180) is conjugate base of 3-(5-hydroxyindol-3-yl)pyruvic acid (CHEBI:27597)
IUPAC Name 
3-(5-hydroxy-1H-indol-3-yl)-2-oxopropanoic acid
Synonym  Source
5-hydroxyindolepyruvic acidKEGG COMPOUND
Manual XrefsDatabases
C05646KEGG COMPOUND
389613ChemSpider
Citations