CHEBI:66887 - (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate(2−)

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ChEBI Name (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate(2−)
ChEBI ID CHEBI:66887
ChEBI ASCII Name (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate(2-)
Definition A 2-hydroxy-6-oxonona-2,4-dienedioate having (2Z,4E)-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
Download Molfile XML SDF
Formula C9H8O6
Net Charge -2
Average Mass 212.15620
Monoisotopic Mass 212.032
InChI InChI=1S/C9H10O6/c10-6(4-5-8(12)13)2-1-3-7(11)9(14)15/h1-3,11H,4-5H2,(H,12,13)(H,14,15)/p-2/b2-1+,7-3-
InChIKey RFENOVFRMPRRJI-YDCWOTKKSA-L
SMILES O\C(=C/C=C/C(=O)CCC([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate(2−) (CHEBI:66887) is a 2-hydroxy-6-oxonona-2,4-dienedioate (CHEBI:19615)
(2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate(2−) (CHEBI:66887) is conjugate base of (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioic acid (CHEBI:66936)
Incoming (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioic acid (CHEBI:66936) is conjugate acid of (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate(2−) (CHEBI:66887)
IUPAC Name
(2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate
Synonym Source
(2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate UniProt
Last Modified
03 August 2012
Submitter Remark
2012-08-03 10:15:40.0 Steve Turner Described in Lam, W. W. Y and Bugg, T. D. H. Chemistry of extradiol aromatic ring cleavage: isolation of a stable dienol ring fission intermediate and stereochemistry of its enzymatic hydrolytic clevage. J. Chem. Soc., Chem. Commun. 10 (1994) 1163-1164.