CHEBI:38407 - muconic acid

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ChEBI Name muconic acid ChEBI ID CHEBI:38407 Definition A hexadienedioic acid with unsaturation at positions 2 and 4. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:25424, CHEBI:36156 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H6O4 Net Charge 0 Average Mass 142.10944 Monoisotopic Mass 142.02661 InChI InChI=1S/C6H6O4/c7-5(8)3-1-2-4-6(9)10/h1-4H,(H,7,8)(H,9,10) InChIKey TXXHDPDFNKHHGW-UHFFFAOYSA-N SMILES [H]C(=CC=C([H])C(O)=O)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. View more via ChEBI Ontology ChEBI Ontology Outgoing muconic acid (CHEBI:38407) has role human xenobiotic metabolite (CHEBI:76967) muconic acid (CHEBI:38407) is a dicarboxylic fatty acid (CHEBI:189840) muconic acid (CHEBI:38407) is a hexadienedioic acid (CHEBI:24553) muconic acid (CHEBI:38407) is conjugate acid of 5-carboxypenta-2,4-dienoate (CHEBI:36504) Incoming (2E,4Z)-2-hydroxymuconic acid (CHEBI:64037) has functional parent muconic acid (CHEBI:38407) (2Z,4E)-2-hydroxymuconic acid (CHEBI:53146) has functional parent muconic acid (CHEBI:38407) 2-aminomuconic acid (CHEBI:16886) has functional parent muconic acid (CHEBI:38407) 3-carboxymethylmuconic acid (CHEBI:28251) has functional parent muconic acid (CHEBI:38407) 3-sulfomuconic acid (CHEBI:27942) has functional parent muconic acid (CHEBI:38407) 5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2H)-one (CHEBI:17881) has functional parent muconic acid (CHEBI:38407) chloromuconic acid (CHEBI:38408) has functional parent muconic acid (CHEBI:38407) cis,cis-muconic acid (CHEBI:16508) is a muconic acid (CHEBI:38407) cis,trans-muconic acid (CHEBI:27671) is a muconic acid (CHEBI:38407) trans,trans-muconic acid (CHEBI:27036) is a muconic acid (CHEBI:38407) 5-carboxypenta-2,4-dienoate (CHEBI:36504) is conjugate base of muconic acid (CHEBI:38407) IUPAC Name hexa-2,4-dienedioic acid Synonyms Sources 1,3-butadiene-1,4-dicarboxylic acid ChemIDplus 2,4-hexadienedioic acid ChEBI butadiene-1,4-dicarboxylic acid ChEBI Registry Numbers Types Sources 1722248 Beilstein Registry Number Beilstein 1756239 Beilstein Registry Number Beilstein 505-70-4 CAS Registry Number ChemIDplus Citations Types Sources 23079953 PubMed citation Europe PMC 23164574 PubMed citation Europe PMC 24657371 PubMed citation Europe PMC 24751381 PubMed citation Europe PMC Last Modified 24 February 2022