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CHEBI:28107 - 2-isopropylmalate(2−)

ChEBI IDCHEBI:28107
ChEBI Name2-isopropylmalate(2−)
Stars
ASCII Name2-isopropylmalate(2-)
DefinitionA dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxylic acid groups of 2-isopropylmalic acid.
Secondary ChEBI IDsCHEBI:1115, CHEBI:19595, CHEBI:35129
Last Modified8 August 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC7H10O5
Net Charge-2
Average Mass174.152
Monoisotopic Mass174.05392
SMILESCC(C)C(O)(CC(=O)[O-])C(=O)[O-]
InChIInChI=1S/C7H12O5/c1-4(2)7(12,6(10)11)3-5(8)9/h4,12H,3H2,1-2H3,(H,8,9)(H,10,11)/p-2
InChIKeyBITYXLXUCSKTJS-UHFFFAOYSA-L
Species of MetaboliteComponentSourceComments
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Role:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
2-isopropylmalate(2−) (CHEBI:28107) has functional parent succinate(2−) (CHEBI:30031)
2-isopropylmalate(2−) (CHEBI:28107) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
2-isopropylmalate(2−) (CHEBI:28107) is a 2-isopropylmalate (CHEBI:132917)
2-isopropylmalate(2−) (CHEBI:28107) is a dicarboxylic acid dianion (CHEBI:28965)
2-isopropylmalate(2−) (CHEBI:28107) is conjugate base of 2-isopropylmalic acid (CHEBI:28635)
Incoming Relation(s)
(2S)-2-isopropylmalate(2−) (CHEBI:1178) is a 2-isopropylmalate(2−) (CHEBI:28107)
2-isopropylmalic acid (CHEBI:28635) is conjugate acid of 2-isopropylmalate(2−) (CHEBI:28107)
IUPAC Name 
2-hydroxy-2-(propan-2-yl)butanedioate
Synonyms  Source
2-hydroxy-2-isopropylsuccinateChEBI
3-carboxy-3-hydroxy-4-methylpentanoateChEBI
3-carboxy-3-hydroxyisocaproateChEBI
α-isopropylmalateMetaCyc
3-hydroxy-4-methyl-3-carboxypentanoateMetaCyc
Manual XrefsDatabases
3-CARBOXY-3-HYDROXY-ISOCAPROATEMetaCyc
Citations