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CHEBI:136782 - 3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate

ChEBI IDCHEBI:136782
ChEBI Name3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate
Stars
ASCII Name3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate
DefinitionA 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate obtained by deprotonation of the carboxy group of 3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid; major species at pH 7.3.
Last Modified5 July 2017
Submitternhn
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-XPPMVYLVSA-M
ChEBI Ontology
Outgoing Relation(s)
3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate (CHEBI:136782) is a 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate (CHEBI:64789)
3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate (CHEBI:136782) is conjugate base of 3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid (CHEBI:137658)
Incoming Relation(s)
3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid (CHEBI:137658) is conjugate acid of 3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate (CHEBI:136782)
IUPAC Name 
(3Z)-3-[(4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoate
Synonyms  Source
3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoateSUBMITTER
3Z-ex-H2HPP(1−)SUBMITTER
UniProt Name  Source
3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvateUniProt
Citations