CHEBI:15749 - 3-carboxy-cis,cis-muconic acid

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ChEBI Name 3-carboxy-cis,cis-muconic acid ChEBI ID CHEBI:15749 ChEBI ASCII Name 3-carboxy-cis,cis-muconic acid Definition The 3-carboxy derivative of cis,cis-muconic acid. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:11767, CHEBI:1468, CHEBI:12801, CHEBI:11766, CHEBI:19976 Supplier Information ZINC000001529461 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H6O6 Net Charge 0 Average Mass 186.11894 Monoisotopic Mass 186.01644 InChI InChI=1S/C7H6O6/c8-5(9)2-1-4(7(12)13)3-6(10)11/h1-3H,(H,8,9)(H,10,11)(H,12,13)/b2-1-,4-3+ InChIKey KJOVGYUGXHIVAY-BXTBVDPRSA-N SMILES OC(=O)\C=C/C(=C\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 ) View more via ChEBI Ontology ChEBI Ontology Outgoing 3-carboxy-cis,cis-muconic acid (CHEBI:15749) is a tricarboxylic acid (CHEBI:27093) 3-carboxy-cis,cis-muconic acid (CHEBI:15749) is conjugate acid of 3-carboxy-cis,cis-muconate(3−) (CHEBI:57496) Incoming 3-carboxy-cis,cis-muconate(3−) (CHEBI:57496) is conjugate base of 3-carboxy-cis,cis-muconic acid (CHEBI:15749) IUPAC Name (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylic acid Synonyms Sources 3-carboxy-cis,cis-muconate ChEBI 3-Carboxy-cis,cis-muconate KEGG COMPOUND beta-carboxy-cis,cis-muconate ChEBI beta-Carboxy-cis,cis-muconate KEGG COMPOUND cis,cis-butadiene-1,2,4-tricarboxylate ChEBI cis,cis-Butadiene-1,2,4-tricarboxylate KEGG COMPOUND Manual Xrefs Databases C00007499 KNApSAcK C01163 KEGG COMPOUND c0191 UM-BBD View more database links Registry Number Type Source 1116-26-3 CAS Registry Number KEGG COMPOUND Last Modified 10 January 2019