EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:64942 - 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid

ChEBI IDCHEBI:64942
ChEBI Name3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid
Stars
DefinitionA 2-oxo monocarboxylic acid that is pyruvic acid substituted at position 3 by a 4-hydroxycyclohex-2-en-1-ylidene group
Last Modified5 July 2017
SubmitterSteve
DownloadsMolfile
FormulaC9H10O4
Net Charge0
Average Mass182.175
Monoisotopic Mass182.05791
SMILES[H]C(C(=O)C(=O)O)=C1C=CC(O)CC1
InChIInChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1,3,5,7,10H,2,4H2,(H,12,13)
InChIKeyMPMDLNLJFJLITQ-UHFFFAOYSA-N
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-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid (CHEBI:64942) has functional parent pyruvic acid (CHEBI:32816)
3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid (CHEBI:64942) is a 2-oxo monocarboxylic acid (CHEBI:35910)
3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid (CHEBI:64942) is a secondary alcohol (CHEBI:35681)
3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid (CHEBI:64942) is conjugate acid of 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate (CHEBI:64789)
Incoming Relation(s)
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid (CHEBI:85357) is a 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid (CHEBI:64942)
3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid (CHEBI:137658) is a 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid (CHEBI:64942)
3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate (CHEBI:64789) is conjugate base of 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid (CHEBI:64942)
IUPAC Name 
3-(4-hydroxycyclohex-2-en-1-ylidene)-2-oxopropanoic acid