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> Main
CHEBI:86396 - monomethyl glutaric acid
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ChEBI Name
monomethyl glutaric acid
ChEBI ID
CHEBI:86396
Definition
A dicarboxylic acid monoester that the monomethyl ester of glutaric acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C6H10O4
Net Charge
0
Average Mass
146.14120
Monoisotopic Mass
146.05791
InChI
InChI=1S/C6H10O4/c1-10-6(9)4-2-3-5(7)8/h2-4H2,1H3,(H,7,8)
InChIKey
IBMRTYCHDPMBFN-UHFFFAOYSA-N
SMILES
COC(=O)CCCC(O)=O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
MetaboLights Study
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
monomethyl glutaric acid (
CHEBI:86396
)
has functional parent
glutaric acid (
CHEBI:17859
)
monomethyl glutaric acid (
CHEBI:86396
)
has role
human urinary metabolite (
CHEBI:84087
)
monomethyl glutaric acid (
CHEBI:86396
)
is a
dicarboxylic acid monoester (
CHEBI:36244
)
IUPAC Name
5-methoxy-5-oxopentanoic acid
Synonyms
Sources
4-(methoxycarbonyl)butyric acid
ChemIDplus
4-methoxycarbonylbutanoic acid
ChemIDplus
monomethyl glutarate
ChemIDplus
Manual Xref
Database
HMDB0000858
HMDB
View more database links
Registry Numbers
Types
Sources
1501-27-5
CAS Registry Number
NIST Chemistry WebBook
1501-27-5
CAS Registry Number
ChemIDplus
1762381
Reaxys Registry Number
Reaxys
Citation
Type
Source
24023812
PubMed citation
Europe PMC
Last Modified
11 February 2016