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> Main
CHEBI:17801 - 4-hydroxy-4-methyl-2-oxoglutaric acid
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ChEBI Name
4-hydroxy-4-methyl-2-oxoglutaric acid
ChEBI ID
CHEBI:17801
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:1847, CHEBI:11997, CHEBI:20383
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Formula
C6H8O6
Net Charge
0
Average Mass
176.12412
Monoisotopic Mass
176.03209
InChI
InChI=1S/C6H8O6/c1-6(12,5(10)11)2-3(7)4(8)9/h12H,2H2,1H3,(H,8,9)(H,10,11)
InChIKey
YRWAMSXHYBBHFL-UHFFFAOYSA-N
SMILES
CC(O)(CC(=O)C(O)=O)C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
4-hydroxy-4-methyl-2-oxoglutaric acid (
CHEBI:17801
)
has functional parent
glutaric acid (
CHEBI:17859
)
4-hydroxy-4-methyl-2-oxoglutaric acid (
CHEBI:17801
)
is a
oxo dicarboxylic acid (
CHEBI:36145
)
4-hydroxy-4-methyl-2-oxoglutaric acid (
CHEBI:17801
)
is conjugate acid of
4-hydroxy-4-methyl-2-oxoglutarate(2−) (
CHEBI:58276
)
Incoming
4-hydroxy-4-methyl-2-oxoglutarate(2−) (
CHEBI:58276
)
is conjugate base of
4-hydroxy-4-methyl-2-oxoglutaric acid (
CHEBI:17801
)
IUPAC Name
2-hydroxy-2-methyl-4-oxopentanedioic acid
Synonyms
Sources
4-Hydroxy-4-methyl-2-oxoglutarate
KEGG COMPOUND
4-Hydroxy-4-methyl-2-oxoglutarate
KEGG COMPOUND
4-hydroxy-4-methyl-2-oxoglutaric acid
UniProt
Manual Xrefs
Databases
C04184
KEGG COMPOUND
C06033
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
130610-51-4
CAS Registry Number
Beilstein
19071-44-4
CAS Registry Number
Beilstein
40525-99-3
CAS Registry Number
Beilstein
Last Modified
28 July 2014