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CHEBI:66945 - 4-nitro-6-oxohepta-2,4-dienedioate

ChEBI IDCHEBI:66945
ChEBI Name4-nitro-6-oxohepta-2,4-dienedioate
Stars
DefinitionA dicarboxylic acid dianion obtained by deprotonation of the carboxy groups of 4-nitro-6-oxohepta-2,4-dienedioic acid; major species at pH 7.3.
Last Modified25 December 2012
SubmitterKAX
DownloadsMolfile
FormulaC7H3NO7
Net Charge-2
Average Mass213.101
Monoisotopic Mass212.99205
SMILESO=C([O-])/C=C/C(=C\C(=O)C(=O)[O-])[N+](=O)[O-]
InChIInChI=1S/C7H5NO7/c9-5(7(12)13)3-4(8(14)15)1-2-6(10)11/h1-3H,(H,10,11)(H,12,13)/p-2/b2-1+,4-3+
InChIKeyWQSLVSOAROUIFS-MVJNYCIBSA-L
ChEBI Ontology
Outgoing Relation(s)
4-nitro-6-oxohepta-2,4-dienedioate (CHEBI:66945) is a dicarboxylic acid dianion (CHEBI:28965)
4-nitro-6-oxohepta-2,4-dienedioate (CHEBI:66945) is conjugate base of 4-nitro-6-oxohepta-2,4-dienedioic acid (CHEBI:67104)
Incoming Relation(s)
4-nitro-6-oxohepta-2,4-dienedioic acid (CHEBI:67104) is conjugate acid of 4-nitro-6-oxohepta-2,4-dienedioate (CHEBI:66945)
IUPAC Name 
(2E,4E)-4-nitro-6-oxohepta-2,4-dienedioate
UniProt Name  Source
4-nitro-6-oxohepta-2,4-dienedioateUniProt
Citations