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CHEBI:132096 - sodium methoxyacetate

Default Structure
ChEBI IDCHEBI:132096
ChEBI Namesodium methoxyacetate
Stars
DefinitionAn organic sodium salt comprising equal numbers of sodium and methoxyacetate ions.
Last Modified1 June 2016
SubmitterSteve
DownloadsMolfile
FormulaC3H5O3.Na
Net Charge0
Average Mass112.060
Monoisotopic Mass112.01364
SMILESCOCC(=O)[O-].[Na+]
InChIInChI=1S/C3H6O3.Na/c1-6-2-3(4)5;/h2H2,1H3,(H,4,5);/q;+1/p-1
InChIKeyCEWQOBFWNPUNRO-UHFFFAOYSA-M
Roles Classification
Biological Roles:
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.
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
sodium methoxyacetate (CHEBI:132096) has part methoxyacetate (CHEBI:132097)
sodium methoxyacetate (CHEBI:132096) has role antineoplastic agent (CHEBI:35610)
sodium methoxyacetate (CHEBI:132096) has role apoptosis inducer (CHEBI:68495)
sodium methoxyacetate (CHEBI:132096) has role human xenobiotic metabolite (CHEBI:76967)
sodium methoxyacetate (CHEBI:132096) has role mutagen (CHEBI:25435)
sodium methoxyacetate (CHEBI:132096) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
sodium methoxyacetate
Synonym  Source
Methoxyacetic acid sodium saltChemIDplus
Registry NumbersSources
Reaxys:3704466Reaxys
CAS:50402-70-5ChemIDplus
Citations