EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:64790 - tetrahydro-4-hydroxyphenylpyruvate

ChEBI IDCHEBI:64790
ChEBI Nametetrahydro-4-hydroxyphenylpyruvate
Stars
DefinitionA 2-oxo monocarboxylic acid anion that is the conjugate base of tetrahydro-4-hydroxyphenylpyruvic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified30 July 2012
SubmitterEugeni Belda
DownloadsMolfile
FormulaC9H11O4
Net Charge-1
Average Mass183.183
Monoisotopic Mass183.06628
SMILESO=C([O-])C(=O)CC1C=CC(O)CC1
InChIInChI=1S/C9H12O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1,3,6-7,10H,2,4-5H2,(H,12,13)/p-1
InChIKeyABMPOYCAXJZJJB-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
tetrahydro-4-hydroxyphenylpyruvate (CHEBI:64790) has functional parent pyruvate (CHEBI:15361)
tetrahydro-4-hydroxyphenylpyruvate (CHEBI:64790) is a 2-oxo monocarboxylic acid anion (CHEBI:35179)
tetrahydro-4-hydroxyphenylpyruvate (CHEBI:64790) is conjugate base of tetrahydro-4-hydroxyphenylpyruvic acid (CHEBI:64808)
Incoming Relation(s)
3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvate (CHEBI:136783) is a tetrahydro-4-hydroxyphenylpyruvate (CHEBI:64790)
3-[(1S,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvate (CHEBI:136784) is a tetrahydro-4-hydroxyphenylpyruvate (CHEBI:64790)
tetrahydro-4-hydroxyphenylpyruvic acid (CHEBI:64808) is conjugate acid of tetrahydro-4-hydroxyphenylpyruvate (CHEBI:64790)
IUPAC Name 
3-(4-hydroxycyclohex-2-en-1-yl)-2-oxopropanoate
Synonyms  Source
H4HPPSUBMITTER
3-(4-hydroxycyclohex-2-enyl)-2-oxopropanoateSUBMITTER
1,2,3,4-tetrahydro-4-hydroxyphenylpyruvateChEBI
UniProt Name  Source
tetrahydro-4-hydroxyphenylpyruvateUniProt
Manual XrefsDatabases
CPD8J2-6MetaCyc