cis,cis-muconate (CHEBI:32379)

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ChEBI Name	cis,cis-muconate

ChEBI ID	CHEBI:32379

ChEBI ASCII Name	cis,cis-muconate

Definition	A muconate that is the conjugate base of (2Z,4Z)-5-carboxypenta-2,4-dienoate.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:12785, CHEBI:23258, CHEBI:23259, CHEBI:12802

Supplier Information	ChemicalBook:CB2402938, eMolecules:502818, Selleckchem:Levodopa(Sinemet), ZINC000000895199

Download	Molfile XML SDF

Formula

C6H4O4

Net Charge

-2

Average Mass

140.09356

Monoisotopic Mass

140.01206

InChI

InChI=1S/C6H6O4/c7-5(8)3-1-2-4-6(9)10/h1-4H,(H,7,8)(H,9,10)/p-2/b3-1-,4-2-

InChIKey

TXXHDPDFNKHHGW-CCAGOZQPSA-L

SMILES

[O-]C(=O)\C=C/C=C\C([O-])=O

Roles Classification
Biological Role(s):	bacterial xenobiotic metabolite Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.

ChEBI Ontology
Outgoing	cis,cis-muconate (CHEBI:32379) has role bacterial xenobiotic metabolite (CHEBI:76976) cis,cis-muconate (CHEBI:32379) is a muconate (CHEBI:36157) cis,cis-muconate (CHEBI:32379) is conjugate base of (2Z,4Z)-5-carboxypenta-2,4-dienoate (CHEBI:36501)

Incoming	2,3,5-trichloro-cis,cis-muconate(2−) (CHEBI:19298) has functional parent cis,cis-muconate (CHEBI:32379) 2,4-dichloro-cis,cis-muconate(2−) (CHEBI:11438) has functional parent cis,cis-muconate (CHEBI:32379) 2,5-dichloro-cis,cis-muconate(2−) (CHEBI:19375) has functional parent cis,cis-muconate (CHEBI:32379) 2-chloro-cis,cis-muconate(2−) (CHEBI:19504) has functional parent cis,cis-muconate (CHEBI:32379) 2-methyl-cis,cis-muconate (CHEBI:231624) has functional parent cis,cis-muconate (CHEBI:32379) 3-chloro-cis,cis-muconate(2−) (CHEBI:17589) has functional parent cis,cis-muconate (CHEBI:32379) 3-methyl-cis,cis-muconate (CHEBI:231634) has functional parent cis,cis-muconate (CHEBI:32379) 4-chloro-2-methyl-cis,cis-muconate (CHEBI:231610) has functional parent cis,cis-muconate (CHEBI:32379) (2Z,4Z)-5-carboxypenta-2,4-dienoate (CHEBI:36501) is conjugate acid of cis,cis-muconate (CHEBI:32379)

IUPAC Name

(2Z,4Z)-hexa-2,4-dienedioate

Synonym	Source
cis,cis-muconate	UniProt

Registry Number	Type	Source
6476541	Reaxys Registry Number	Reaxys

Last Modified

05 July 2016