CHEBI:87504 - (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate

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ChEBI Name (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate ChEBI ID CHEBI:87504 ChEBI ASCII Name (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate Definition A dicarboxylic acid dianion obtained by deprotonation of the carboxy groups of 2-hydroxyhepta-2,4-diene-1,7-dioic acid; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen 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 C7H6O5 Net Charge -2 Average Mass 170.120 Monoisotopic Mass 170.02262 InChI InChI=1S/C7H8O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-3,8H,4H2,(H,9,10)(H,11,12)/p-2/b2-1-,5-3- InChIKey ZBCBETMBSDTINL-NWJCXACMSA-L SMILES C(=C/C=C(/C([O-])=O)\O)/CC([O-])=O ChEBI Ontology Outgoing (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate (CHEBI:87504) is a polyunsaturated dicarboxylic acid dianion (CHEBI:133492) (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate (CHEBI:87504) is conjugate base of (2Z,4Z)-2-hydroxyhepta-2,4-dienedioic acid (CHEBI:87771) (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate (CHEBI:87504) is tautomer of (4Z)-2-oxohept-4-enedioate (CHEBI:87507) Incoming (2Z,4Z)-2-hydroxyhepta-2,4-dienedioic acid (CHEBI:87771) is conjugate acid of (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate (CHEBI:87504) (4Z)-2-oxohept-4-enedioate (CHEBI:87507) is tautomer of (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate (CHEBI:87504) IUPAC Name (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate Synonym Source (2Z,4Z)-2-hydroxyhepta-2,4-diene-1,7-dioate UniProt Registry Number Type Source 5866185 Reaxys Registry Number Reaxys Last Modified 16 September 2021

General Comment 2015-09-02 See: Johnson, W.H., Hajipour, G. and Whitman, C.P. J. Am. Chem. Soc. 117, 8719-8726 (1995). DOI: 10.1021/ja00139a004