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> Main
CHEBI:132098 - methoxyacetic acid
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ChEBI Name
methoxyacetic acid
ChEBI ID
CHEBI:132098
Definition
A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is replaced by a methoxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C3H6O3
Net Charge
0
Average Mass
90.078
Monoisotopic Mass
90.03169
InChI
InChI=1S/C3H6O3/c1-6-2-3(4)5/h2H2,1H3,(H,4,5)
InChIKey
RMIODHQZRUFFFF-UHFFFAOYSA-N
SMILES
C(=O)(O)COC
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 xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
apoptosis inducer
Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
mutagen
An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.
Application
(s):
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
methoxyacetic acid (
CHEBI:132098
)
has functional parent
acetic acid (
CHEBI:15366
)
methoxyacetic acid (
CHEBI:132098
)
has role
antineoplastic agent (
CHEBI:35610
)
methoxyacetic acid (
CHEBI:132098
)
has role
apoptosis inducer (
CHEBI:68495
)
methoxyacetic acid (
CHEBI:132098
)
has role
human xenobiotic metabolite (
CHEBI:76967
)
methoxyacetic acid (
CHEBI:132098
)
has role
mutagen (
CHEBI:25435
)
methoxyacetic acid (
CHEBI:132098
)
is a
ether (
CHEBI:25698
)
methoxyacetic acid (
CHEBI:132098
)
is a
monocarboxylic acid (
CHEBI:25384
)
methoxyacetic acid (
CHEBI:132098
)
is conjugate acid of
methoxyacetate (
CHEBI:132097
)
Incoming
methoxyacetate (
CHEBI:132097
)
is conjugate base of
methoxyacetic acid (
CHEBI:132098
)
IUPAC Name
methoxyacetic acid
Synonyms
Sources
2-Methoxyacetic acid
ChemIDplus
CH3OCH2COOH
NIST Chemistry WebBook
Methoxyethanoic acid
HMDB
Manual Xrefs
Databases
CPD-12993
MetaCyc
HMDB0041929
HMDB
View more database links
Registry Numbers
Types
Sources
625-45-6
CAS Registry Number
NIST Chemistry WebBook
625-45-6
CAS Registry Number
ChemIDplus
635800
Reaxys Registry Number
Reaxys
Citations
Types
Sources
23290149
PubMed citation
Europe PMC
23290947
PubMed citation
Europe PMC
24798094
PubMed citation
Europe PMC
25606576
PubMed citation
Europe PMC
26001161
PubMed citation
Europe PMC
26006246
PubMed citation
Europe PMC
26802500
PubMed citation
Europe PMC
Last Modified
31 May 2016