CHEBI:17424 - 4-carboxy-2-hydroxy-cis,cis-muconic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-carboxy-2-hydroxy-cis,cis-muconic acid
ChEBI ID CHEBI:17424
ChEBI ASCII Name 4-carboxy-2-hydroxy-cis,cis-muconic acid
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:20323, CHEBI:1791, CHEBI:11965
Supplier Information
Download Molfile XML SDF
Formula C7H6O7
Net Charge 0
Average Mass 202.11834
Monoisotopic Mass 202.01135
InChI InChI=1S/C7H6O7/c8-4(7(13)14)1-3(6(11)12)2-5(9)10/h1-2,8H,(H,9,10)(H,11,12)(H,13,14)/b3-2+,4-1+
InChIKey QWLUKZXOQAQUFQ-DXLKSGPOSA-N
SMILES OC(=O)\C=C(/C=C(/O)C(O)=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 4-carboxy-2-hydroxy-cis,cis-muconic acid (CHEBI:17424) is a 4-carboxy-2-hydroxyhexa-2,4-dienedioic acid (CHEBI:16321)
4-carboxy-2-hydroxy-cis,cis-muconic acid (CHEBI:17424) is conjugate acid of 4-carboxy-2-hydroxy-cis,cis-muconate(3−) (CHEBI:58142)
Incoming 4-carboxy-2-hydroxy-cis,cis-muconate(3−) (CHEBI:58142) is conjugate base of 4-carboxy-2-hydroxy-cis,cis-muconic acid (CHEBI:17424)
IUPAC Name
(1E,3E)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid
Synonyms Sources
4-Carboxy-2-hydroxy-cis,cis-muconate KEGG COMPOUND
4-carboxy-2-hydroxy-cis,cis-muconate ChEBI
4-carboxy-2-hydroxy-cis,cis-muconic acid UniProt
4-Carboxy-2-hydroxyhexa-2,4-cis,cis-dienedioate KEGG COMPOUND
Manual Xref Database
C04324 KEGG COMPOUND
View more database links
Registry Number Type Source
2265115 Reaxys Registry Number Reaxys
Last Modified
24 February 2011