CHEBI:27040 - trans-2-carboxybenzylidenepyruvate(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name trans-2-carboxybenzylidenepyruvate(2−)
ChEBI ID CHEBI:27040
ChEBI ASCII Name trans-2-carboxybenzylidenepyruvate(2-)
Definition A dicarboxylic acid dianion resulting from removal of a proton from both carboxy groups of trans-2-carboxybenzylidenepyruvic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C11H6O5
Net Charge -2
Average Mass 218.16230
Monoisotopic Mass 218.02262
InChI InChI=1S/C11H8O5/c12-9(11(15)16)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H,(H,13,14)(H,15,16)/p-2/b6-5+
InChIKey APKXMKWCGDBYNV-AATRIKPKSA-L
SMILES [O-]C(=O)C(=O)\C=C\c1ccccc1C([O-])=O
ChEBI Ontology
Outgoing trans-2-carboxybenzylidenepyruvate(2−) (CHEBI:27040) has functional parent pyruvate (CHEBI:15361)
trans-2-carboxybenzylidenepyruvate(2−) (CHEBI:27040) is a dicarboxylic acid dianion (CHEBI:28965)
IUPAC Name
2-[(1E)-3-carboxylato-3-oxoprop-1-en-1-yl]benzoate
Synonyms Sources
(3E)-4-(2-Carboxyphenyl)-2-oxobut-3-enoate KEGG COMPOUND
(E)-2-carboxybenzalpyruvate ChEBI
(E)-2-carboxybenzylidenepyruvate ChEBI
2-[(E)-3-carboxylato-3-oxoprop-1-en-1-yl]benzoate ChEBI
trans-2-carboxybenzalpyruvate ChEBI
trans-2-carboxybenzylidenepyruvate anion ChEBI
trans-2-carboxybenzylidenepyruvate dianion ChEBI
Manual Xref Database
C01275 KEGG COMPOUND
View more database links
Last Modified
25 March 2011