CHEBI:17142 - 5-formyl-2-hydroxyhepta-2,4-dienedioic acid

ChEBI IDCHEBI:17142
ChEBI Name5-formyl-2-hydroxyhepta-2,4-dienedioic acid
Stars
Secondary ChEBI IDsCHEBI:1129, CHEBI:11586, CHEBI:12114, CHEBI:27029
Last Modified3 August 2014
DownloadsMolfile
FormulaC8H8O6
Net Charge0
Average Mass200.146
Monoisotopic Mass200.03209
SMILES[H]C(=O)/C(=C\C=C(/O)C(=O)O)CC(=O)O
InChIInChI=1S/C8H8O6/c9-4-5(3-7(11)12)1-2-6(10)8(13)14/h1-2,4,10H,3H2,(H,11,12)(H,13,14)/b5-1-,6-2-
InChIKeyNLXIEJRQAIHYPN-IOBHVTPZSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
5-formyl-2-hydroxyhepta-2,4-dienedioic acid (CHEBI:17142) is a muconic semialdehyde (CHEBI:38436)
5-formyl-2-hydroxyhepta-2,4-dienedioic acid (CHEBI:17142) is conjugate acid of 5-formyl-2-hydroxyhepta-2,4-dienedioate (CHEBI:58030)
Incoming Relation(s)
5-formyl-2-hydroxyhepta-2,4-dienedioate (CHEBI:58030) is conjugate base of 5-formyl-2-hydroxyhepta-2,4-dienedioic acid (CHEBI:17142)
IUPAC Name 
5-formyl-2-hydroxyhepta-2,4-dienedioic acid
Synonyms  Source
2-Hydroxy-5-carboxymethylmuconate semialdehydeKEGG COMPOUND
5-Carboxymethyl-2-hydroxymuconate semialdehydeKEGG COMPOUND
5-Carboxymethyl-2-hydroxymuconic semialdehydeKEGG COMPOUND
Manual XrefsDatabases
c0305UM-BBD
C04642KEGG COMPOUND
Registry NumbersSources
CAS:2461-62-3KEGG COMPOUND