3-hydroxy-3-methylglutarate(2-) (CHEBI:17325)

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ChEBI Name	3-hydroxy-3-methylglutarate(2−)

ChEBI ID	CHEBI:17325

ChEBI ASCII Name	3-hydroxy-3-methylglutarate(2-)

Definition	A dicarboxylic acid dianion that results from the removal of a proton from both of the carboxylic acid groups of 3-hydroxy-3-methylglutaric acid.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:11813, CHEBI:20042

Supplier Information

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Formula

C6H8O5

Net Charge

-2

Average Mass

160.12470

Monoisotopic Mass

160.03827

InChI

InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)/p-2

InChIKey

NPOAOTPXWNWTSH-UHFFFAOYSA-L

SMILES

CC(O)(CC([O-])=O)CC([O-])=O

Roles Classification
Biological Role(s):	human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	3-hydroxy-3-methylglutarate(2−) (CHEBI:17325) has functional parent glutarate(2−) (CHEBI:30921) 3-hydroxy-3-methylglutarate(2−) (CHEBI:17325) has role human metabolite (CHEBI:77746) 3-hydroxy-3-methylglutarate(2−) (CHEBI:17325) has role plant metabolite (CHEBI:76924) 3-hydroxy-3-methylglutarate(2−) (CHEBI:17325) is a 3-hydroxydicarboxylate(2−) (CHEBI:133251) 3-hydroxy-3-methylglutarate(2−) (CHEBI:17325) is a dicarboxylic acid dianion (CHEBI:28965) 3-hydroxy-3-methylglutarate(2−) (CHEBI:17325) is conjugate base of 3-hydroxy-3-methylglutarate(1−) (CHEBI:30920)

Incoming	3-hydroxy-3-methylglutarate(1−) (CHEBI:30920) is conjugate acid of 3-hydroxy-3-methylglutarate(2−) (CHEBI:17325)

IUPAC Name

3-hydroxy-3-methylpentanedioate

Synonym	Source
3-hydroxy-3-methylglutarate	UniProt

Last Modified

23 October 2015