CHEBI:57471 - (1E)-4-oxobut-1-ene-1,2,4-tricarboxylate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (1E)-4-oxobut-1-ene-1,2,4-tricarboxylate
ChEBI ID CHEBI:57471
ChEBI ASCII Name (1E)-4-oxobut-1-ene-1,2,4-tricarboxylate
Definition Trianion of (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid arising from deprotonation of all three carboxylic acid groups.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C7H3O7
Net Charge -3
Average Mass 199.09450
Monoisotopic Mass 198.98952
InChI InChI=1S/C7H6O7/c8-4(7(13)14)1-3(6(11)12)2-5(9)10/h2H,1H2,(H,9,10)(H,11,12)(H,13,14)/p-3/b3-2+
InChIKey ODTDYYZJDQGKQT-NSCUHMNNSA-K
SMILES [O-]C(=O)\C=C(/CC(=O)C([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing (1E)-4-oxobut-1-ene-1,2,4-tricarboxylate (CHEBI:57471) is a tricarboxylic acid trianion (CHEBI:27092)
(1E)-4-oxobut-1-ene-1,2,4-tricarboxylate (CHEBI:57471) is conjugate base of (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid (CHEBI:15668)
Incoming (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid (CHEBI:15668) is conjugate acid of (1E)-4-oxobut-1-ene-1,2,4-tricarboxylate (CHEBI:57471)
IUPAC Name
(1E)-4-oxobut-1-ene-1,2,4-tricarboxylate
Synonym Source
(1E)-4-oxobut-1-ene-1,2,4-tricarboxylate UniProt
Registry Number Type Source
1124055 Beilstein Registry Number Beilstein
Last Modified
01 February 2013