CHEBI:47904 - 4-maleylacetoacetic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways
ChEBI Name 4-maleylacetoacetic acid
ChEBI ID CHEBI:47904
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1888, CHEBI:20434
Supplier Information
Save molfile Download Molfile
Formula C8H8O6
Net Charge 0
Average Mass 200.14552
InChI InChI=1S/C8H8O6/c9-5(1-2-7(11)12)3-6(10)4-8(13)14/h1-2H,3-4H2,(H,11,12)(H,13,14)/b2-1-
InChIKey GACSIVHAIFQKTC-UPHRSURJSA-N
SMILES OC(=O)CC(=O)CC(=O)\C=C/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-maleylacetoacetic acid (CHEBI:47904) has functional parent oct-2-enedioic acid (CHEBI:36279)
4-maleylacetoacetic acid (CHEBI:47904) is a β-diketone (CHEBI:67265)
4-maleylacetoacetic acid (CHEBI:47904) is a oxo dicarboxylic acid (CHEBI:36145)
4-maleylacetoacetic acid (CHEBI:47904) is conjugate acid of 4-maleylacetoacetate (CHEBI:17105)
Incoming 4-maleylacetoacetate (CHEBI:17105) is conjugate base of 4-maleylacetoacetic acid (CHEBI:47904)
IUPAC Name
(2Z)-4,6-dioxooct-2-enedioic acid
Synonyms Sources
4-Maleylacetoacetate KEGG COMPOUND
4-Maleylacetoacetic acid KEGG COMPOUND
Database Links Databases
C00007508 KNApSAcK
C01036 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1726100 Beilstein Registry Number Beilstein
5698-52-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014