CHEBI:23994 - ethyl methanesulfonate

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ChEBI Name ethyl methanesulfonate
ChEBI ID CHEBI:23994
Definition A methanesulfonate ester resulting from the formal condensation of methanesulfonic acid with ethanol.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C3H8O3S
Net Charge 0
Average Mass 124.15900
Monoisotopic Mass 124.019
InChI InChI=1S/C3H8O3S/c1-3-6-7(2,4)5/h3H2,1-2H3
InChIKey PLUBXMRUUVWRLT-UHFFFAOYSA-N
SMILES CCOS(C)(=O)=O
Roles Classification
Biological Role(s): alkylating agent
Highly reactive chemical that introduces alkyl radicals into biologically active molecules and thereby prevents their proper functioning. It could be used as an antineoplastic agent, but it might be very toxic, with carcinogenic, mutagenic, teratogenic, and immunosuppressant actions. It could also be used as a component of poison gases.
carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
genotoxin
A role played by a chemical compound to induce direct or indirect DNA damage. Such damage can potentially lead to the formation of a malignant tumour, but DNA damage does not lead inevitably to the creation of cancerous cells.
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.
teratogenic agent
A role played by a chemical compound in biological systems with adverse consequences in embryo developments, leading to birth defects, embryo death or altered development, growth retardation and functional defect.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ethyl methanesulfonate (CHEBI:23994) has role alkylating agent (CHEBI:22333)
ethyl methanesulfonate (CHEBI:23994) has role antineoplastic agent (CHEBI:35610)
ethyl methanesulfonate (CHEBI:23994) has role carcinogenic agent (CHEBI:50903)
ethyl methanesulfonate (CHEBI:23994) has role genotoxin (CHEBI:50902)
ethyl methanesulfonate (CHEBI:23994) has role mutagen (CHEBI:25435)
ethyl methanesulfonate (CHEBI:23994) has role teratogenic agent (CHEBI:50905)
ethyl methanesulfonate (CHEBI:23994) is a methanesulfonate ester (CHEBI:25223)
Synonyms Sources
EMS ChemIDplus
ethyl mesylate ChemIDplus
ethyl methanesulphonate ChemIDplus
methylsulfonic acid ethyl ester ChemIDplus
methylsulfonic acid, ethyl ester ChemIDplus
Manual Xrefs Databases
C19239 KEGG COMPOUND
Ethyl_methanesulfonate Wikipedia
View more database links
Registry Numbers Types Sources
62-50-0 CAS Registry Number ChemIDplus
62-50-0 CAS Registry Number NIST Chemistry WebBook
773969 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
16039156 PubMed citation Europe PMC
19797863 PubMed citation Europe PMC
20102787 PubMed citation Europe PMC
24475756 PubMed citation Europe PMC
24524729 PubMed citation Europe PMC
24531730 PubMed citation Europe PMC
24728647 PubMed citation Europe PMC
6936603 PubMed citation Europe PMC
7285888 PubMed citation Europe PMC
Last Modified
28 July 2014