CHEBI:17589 - 3-chloro-cis,cis-muconate(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-chloro-cis,cis-muconate(2−)
ChEBI ID CHEBI:17589
ChEBI ASCII Name 3-chloro-cis,cis-muconate(2-)
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:19980, CHEBI:11768
Supplier Information
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Formula C6H3ClO4
Net Charge -2
Average Mass 174.53832
Monoisotopic Mass 173.97308
InChI InChI=1S/C6H5ClO4/c7-4(3-6(10)11)1-2-5(8)9/h1-3H,(H,8,9)(H,10,11)/p-2/b2-1-,4-3+
InChIKey ICMVYBXQDUXEEE-BXTBVDPRSA-L
SMILES [O-]C(=O)\C=C/C(Cl)=C\C([O-])=O
ChEBI Ontology
Outgoing 3-chloro-cis,cis-muconate(2−) (CHEBI:17589) has functional parent cis,cis-muconate (CHEBI:32379)
3-chloro-cis,cis-muconate(2−) (CHEBI:17589) is a chlorocarboxylic acid anion (CHEBI:38411)
3-chloro-cis,cis-muconate(2−) (CHEBI:17589) is conjugate base of 3-chloro-cis,cis-muconic acid (CHEBI:1472)
Incoming 3-chloro-cis,cis-muconic acid (CHEBI:1472) is conjugate acid of 3-chloro-cis,cis-muconate(2−) (CHEBI:17589)
IUPAC Name
(2E,4Z)-3-chlorohexa-2,4-dienedioate
Synonym Source
3-chloro-cis,cis-muconate UniProt
Manual Xref Database
c0297 UM-BBD
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Registry Number Type Source
3606608 Beilstein Registry Number Beilstein
Last Modified
22 April 2015