CHEBI:27035 - trans,trans-muconate

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ChEBI Name trans,trans-muconate ChEBI ID CHEBI:27035 ChEBI ASCII Name trans,trans-muconate Definition A muconate that is the dianion obtained by the deprotonation of both the carboxy groups of trans,trans-muconic acid. Stars This entity has been manually annotated by the ChEBI Team. 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 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-ZPUQHVIOSA-L SMILES [O-]C(=O)\C=C\C=C\C([O-])=O Roles Classification 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 trans,trans-muconate (CHEBI:27035) has role human xenobiotic metabolite (CHEBI:76967) trans,trans-muconate (CHEBI:27035) is a dicarboxylic acid dianion (CHEBI:28965) trans,trans-muconate (CHEBI:27035) is a muconate (CHEBI:36157) trans,trans-muconate (CHEBI:27035) is conjugate base of (2E,4E)-5-carboxypenta-2,4-dienoate (CHEBI:36502) Incoming (2E,4E)-5-carboxypenta-2,4-dienoate (CHEBI:36502) is conjugate acid of trans,trans-muconate (CHEBI:27035) IUPAC Name (2E,4E)-hexa-2,4-dienedioate Synonyms Sources (E,E)-muconate ChEBI trans,trans-2,4-hexadienedioic acid ChEBI trans,trans-Buta-1,3-diene-1,4-dicarboxylate ChEBI Registry Number Type Source 5330368 Reaxys Registry Number Reaxys Last Modified 16 September 2021