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CHEBI:30926 - 3-oxalomalic acid

Default Structure
ChEBI IDCHEBI:30926
ChEBI Name3-oxalomalic acid
Stars
Secondary ChEBI IDsCHEBI:1618, CHEBI:20147
Last Modified25 February 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H6O8
Net Charge0
Average Mass206.106
Monoisotopic Mass206.00627
SMILESO=C(O)C(=O)C(C(=O)O)C(O)C(=O)O
InChIInChI=1S/C6H6O8/c7-2(5(11)12)1(4(9)10)3(8)6(13)14/h1-2,7H,(H,9,10)(H,11,12)(H,13,14)
InChIKeyYILAUJBAPQXZGM-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)
3-oxalomalic acid (CHEBI:30926) is a tricarboxylic acid (CHEBI:27093)
3-oxalomalic acid (CHEBI:30926) is conjugate acid of 3-oxalomalate(3−) (CHEBI:15593)
Incoming Relation(s)
3-oxalomalate(3−) (CHEBI:15593) is conjugate base of 3-oxalomalic acid (CHEBI:30926)
IUPAC Name 
1-hydroxy-3-oxopropane-1,2,3-tricarboxylic acid
Synonyms  Source
1-hydroxy-3-oxo-1,2,3-propanetricarboxylic acidChemIDplus
3-Oxalomalic acidKEGG COMPOUND
Manual XrefsDatabases
C01990KEGG COMPOUND
LSM-5156LINCS
Registry NumbersSources
Beilstein:1797015Beilstein
CAS:3687-15-8ChemIDplus
CAS:3687-15-8KEGG COMPOUND
CAS:89304-26-7KEGG COMPOUND