CHEBI:84355 - 3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate

ChEBI IDCHEBI:84355
ChEBI Name3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate
Stars
ASCII Name3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate
Definition3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate obtained by deprotonation of the carboxy group of 3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid; major species at pH 7.3.
Last Modified6 April 2015
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC9H9O4
Net Charge-1
Average Mass181.167
Monoisotopic Mass181.05063
SMILESO=C([O-])C(=O)/C=C1/C=C[C@H](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)/p-1/b6-5-/t7-/m0/s1
InChIKeyMPMDLNLJFJLITQ-RBSILHGTSA-M
Species of MetaboliteComponentSourceComments
Bacillus subtilis (ncbitaxon:1423) - PubMed (23317005)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate (CHEBI:84355) has role bacterial metabolite (CHEBI:76969)
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate (CHEBI:84355) is a 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate (CHEBI:64789)
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate (CHEBI:84355) is conjugate base of 3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid (CHEBI:85357)
Incoming Relation(s)
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid (CHEBI:85357) is conjugate acid of 3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate (CHEBI:84355)
IUPAC Name 
(3E)-3-[(4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoate
UniProt Name  Source
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvateUniProt
Manual XrefsDatabases
CPD-17511MetaCyc
Citations