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CHEBI:64037 - (2E,4Z)-2-hydroxymuconic acid

Default Structure
ChEBI IDCHEBI:64037
ChEBI Name(2E,4Z)-2-hydroxymuconic acid
Stars
ASCII Name(2E,4Z)-2-hydroxymuconic acid
DefinitionA hexadienedioic acid compound having a 2-hydroxy substituent and with configuration (2E,4Z); 2-hydroxylated cis,cis-muconic acid
Last Modified24 February 2022
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H6O5
Net Charge0
Average Mass158.109
Monoisotopic Mass158.02152
SMILESO=C(O)/C=C\C=C(\O)C(=O)O
InChIInChI=1S/C6H6O5/c7-4(6(10)11)2-1-3-5(8)9/h1-3,7H,(H,8,9)(H,10,11)/b3-1-,4-2+
InChIKeyJBEBGTMCZIGUTK-HSFFGMMNSA-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)
(2E,4Z)-2-hydroxymuconic acid (CHEBI:64037) has functional parent muconic acid (CHEBI:38407)
(2E,4Z)-2-hydroxymuconic acid (CHEBI:64037) is a 2-hydroxydicarboxylic acid (CHEBI:50263)
(2E,4Z)-2-hydroxymuconic acid (CHEBI:64037) is a dicarboxylic fatty acid (CHEBI:189840)
(2E,4Z)-2-hydroxymuconic acid (CHEBI:64037) is a hexadienedioic acid (CHEBI:24553)
(2E,4Z)-2-hydroxymuconic acid (CHEBI:64037) is conjugate acid of (2E,4Z)-2-hydroxymuconate(2−) (CHEBI:64016)
Incoming Relation(s)
(2E,4Z)-2-hydroxymuconate(2−) (CHEBI:64016) is conjugate base of (2E,4Z)-2-hydroxymuconic acid (CHEBI:64037)
IUPAC Name 
(2E,4Z)-2-hydroxyhexa-2,4-dienedioic acid
Synonym  Source
2-hydroxy-cis,cis-muconic acidChEBI
Manual XrefsDatabases
C02501KEGG COMPOUND
Registry NumbersSources
Reaxys:1937494Reaxys
Citations