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CHEBI:17250 - 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid

ChEBI IDCHEBI:17250
ChEBI Name2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid
Stars
DefinitionA tricarboxylic acid that is the 2-oxo derivative of homocitric acid.
Secondary ChEBI IDsCHEBI:1128, CHEBI:1797, CHEBI:11585, CHEBI:19611, CHEBI:20327, CHEBI:28186
Last Modified7 January 2019
DownloadsMolfile
FormulaC7H8O8
Net Charge0
Average Mass220.133
Monoisotopic Mass220.02192
SMILESO=C(O)CC(O)(CC(=O)C(=O)O)C(=O)O
InChIInChI=1S/C7H8O8/c8-3(5(11)12)1-7(15,6(13)14)2-4(9)10/h15H,1-2H2,(H,9,10)(H,11,12)(H,13,14)
InChIKeyRQMCNDRMPZBEOD-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid (CHEBI:17250) has functional parent homocitric acid (CHEBI:17852)
2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid (CHEBI:17250) is a tricarboxylic acid (CHEBI:27093)
2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid (CHEBI:17250) is conjugate acid of 2-hydroxy-4-oxobutane-1,2,4-tricarboxylate (CHEBI:58075)
Incoming Relation(s)
(2S)-2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid (CHEBI:142757) is a 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid (CHEBI:17250)
2-hydroxy-4-oxobutane-1,2,4-tricarboxylate (CHEBI:58075) is conjugate base of 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid (CHEBI:17250)
IUPAC Name 
2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid
Synonyms  Source
4-carboxy-4-hydroxy-2-oxoadipic acidChEBI
4-hydroxy-4-carboxymethyl-2-oxoglutaric acidChEBI
Manual XrefsDatabases
C04115KEGG COMPOUND