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CHEBI:234122 - nifurstyrenate

ChEBI IDCHEBI:234122
ChEBI Namenifurstyrenate
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DefinitionA monocarboxylic acid anion that is the conjugate base of nifurstyrenic acid resulting from the deprotonation of the carboxy group; Major species at pH 7.3.
Last Modified25 April 2025
SubmitterAdnan
DownloadsMolfile
FormulaC13H8NO5
Net Charge-1
Average Mass258.209
Monoisotopic Mass258.04080
SMILES[H]C(=Cc1ccc([N+](=O)[O-])o1)c1ccc(C(=O)[O-])cc1
InChIInChI=1S/C13H9NO5/c15-13(16)10-4-1-9(2-5-10)3-6-11-7-8-12(19-11)14(17)18/h1-8H,(H,15,16)/p-1
InChIKeyNWSQQZAVPSDJIB-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
nifurstyrenate (CHEBI:234122) is a benzoates (CHEBI:22718)
nifurstyrenate (CHEBI:234122) is a monocarboxylic acid anion (CHEBI:35757)
nifurstyrenate (CHEBI:234122) is conjugate base of nifurstyrenic acid (CHEBI:234119)
Incoming Relation(s)
sodium nifurstyrenate (CHEBI:234123) has part nifurstyrenate (CHEBI:234122)
(E)-nifurstyrenate (CHEBI:234140) is a nifurstyrenate (CHEBI:234122)
(Z)-nifurstyrenate (CHEBI:234141) is a nifurstyrenate (CHEBI:234122)
nifurstyrenic acid (CHEBI:234119) is conjugate acid of nifurstyrenate (CHEBI:234122)
IUPAC Name 
4-[2-(5-nitrofuran-2-yl)ethenyl]benzoate