CHEBI:82686 - 2-oxohept-4-ene-1,7-dioic acid

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ChEBI Name 2-oxohept-4-ene-1,7-dioic acid ChEBI ID CHEBI:82686 Definition An oxo dicarboxylic acid that is 2-oxohept-4-ene in which the two terminal methyl groups are replaced by carboxy groups. 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 C7H8O5 Net Charge 0 Average Mass 172.13540 Monoisotopic Mass 172.03717 InChI InChI=1S/C7H8O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-2H,3-4H2,(H,9,10)(H,11,12)/b2-1+ InChIKey ICGKEQXHPZUYSF-OWOJBTEDSA-N SMILES OC(=O)C\C=C\CC(=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 2-oxohept-4-ene-1,7-dioic acid (CHEBI:82686) is a dicarboxylic fatty acid (CHEBI:189840) 2-oxohept-4-ene-1,7-dioic acid (CHEBI:82686) is a olefinic compound (CHEBI:78840) 2-oxohept-4-ene-1,7-dioic acid (CHEBI:82686) is a oxo dicarboxylic acid (CHEBI:36145) 2-oxohept-4-ene-1,7-dioic acid (CHEBI:82686) is conjugate acid of 2-oxohept-4-ene-1,7-dioate (CHEBI:78627) 2-oxohept-4-ene-1,7-dioic acid (CHEBI:82686) is tautomer of 2-hydroxyhepta-2,4-dienedioic acid (CHEBI:1162) Incoming 2-oxohept-4-ene-1,7-dioate (CHEBI:78627) is conjugate base of 2-oxohept-4-ene-1,7-dioic acid (CHEBI:82686) 2-hydroxyhepta-2,4-dienedioic acid (CHEBI:1162) is tautomer of 2-oxohept-4-ene-1,7-dioic acid (CHEBI:82686) IUPAC Name (3E)-6-oxohept-3-enedioic acid Synonym Source 2-ketohept-4-ene-1,7-dioic acid ChEBI Last Modified 24 February 2022