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CHEBI:42819 - 5-dehydro-4-deoxy-D-glucarate(2−)

ChEBI IDCHEBI:42819
ChEBI Name5-dehydro-4-deoxy-D-glucarate(2−)
Stars
ASCII Name5-dehydro-4-deoxy-D-glucarate(2-)
DefinitionA dicarboxylic acid dianion obtained by removal of a proton from both of the carboxylic acid groups of 5-dehydro-4-deoxy-D-glucarate.
Secondary ChEBI IDsCHEBI:35454, CHEBI:42815, CHEBI:43704
Last Modified29 March 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H6O7
Net Charge-2
Average Mass190.107
Monoisotopic Mass190.01245
SMILESO=C([O-])C(=O)C[C@H](O)[C@@H](O)C(=O)[O-]
InChIInChI=1S/C6H8O7/c7-2(4(9)6(12)13)1-3(8)5(10)11/h2,4,7,9H,1H2,(H,10,11)(H,12,13)/p-2/t2-,4+/m0/s1
InChIKeyQUURPCHWPQNNGL-ZAFYKAAXSA-L
ChEBI Ontology
Outgoing Relation(s)
5-dehydro-4-deoxy-D-glucarate(2−) (CHEBI:42819) has functional parent D-glucarate(2−) (CHEBI:30612)
5-dehydro-4-deoxy-D-glucarate(2−) (CHEBI:42819) is a dicarboxylic acid dianion (CHEBI:28965)
5-dehydro-4-deoxy-D-glucarate(2−) (CHEBI:42819) is conjugate base of 5-dehydro-4-deoxy-D-glucarate(1−) (CHEBI:35453)
Incoming Relation(s)
5-dehydro-4-deoxy-D-glucarate(1−) (CHEBI:35453) is conjugate acid of 5-dehydro-4-deoxy-D-glucarate(2−) (CHEBI:42819)
IUPAC Name 
3-deoxy-L-threo-hex-2-ulosarate
Synonyms  Source
2,3-DIHYDROXY-5-OXO-HEXANEDIOATEPDBeChem
3-deoxy-(L)-threo-2-hexulosarateMetaCyc
5-Dehydro-4-deoxy-D-glucarateKEGG COMPOUND
5-KDGMetaCyc
UniProt Name  Source
5-dehydro-4-deoxy-D-glucarateUniProt
Manual XrefsDatabases
5-KETO-4-DEOXY-D-GLUCARATEMetaCyc
C00679KEGG COMPOUND
DB03237DrugBank