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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-formyl-2-hydroxyhepta-2,4-dienedioic acid
ChEBI ID CHEBI:17142
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12114, CHEBI:27029, CHEBI:11586, CHEBI:1129
Supplier Information
Download Molfile XML SDF
Formula C8H8O6
Net Charge 0
Average Mass 200.14552
Monoisotopic Mass 200.03209
InChI InChI=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-
InChIKey NLXIEJRQAIHYPN-IOBHVTPZSA-N
SMILES [H]C(=O)C(\CC(O)=O)=C/C=C(\O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 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 Sources
2-Hydroxy-5-carboxymethylmuconate semialdehyde KEGG COMPOUND
5-Carboxymethyl-2-hydroxymuconate semialdehyde KEGG COMPOUND
5-Carboxymethyl-2-hydroxymuconic semialdehyde KEGG COMPOUND
Manual Xrefs Databases
c0305 UM-BBD
C04642 KEGG COMPOUND
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Registry Number Type Source
2461-62-3 CAS Registry Number KEGG COMPOUND
Last Modified
04 August 2014