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ethyl methanesulfonate - Ontology Report - Rat Genome Database

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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:ethyl methanesulfonate
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Accession:CHEBI:23994 term browser browse the term
Definition:A methanesulfonate ester resulting from the formal condensation of methanesulfonic acid with ethanol.
Synonyms:related_synonym: EMS;   Formula=C3H8O3S;   InChI=1S/C3H8O3S/c1-3-6-7(2,4)5/h3H2,1-2H3;   InChIKey=PLUBXMRUUVWRLT-UHFFFAOYSA-N;   SMILES=CCOS(C)(=O)=O;   ethyl mesylate;   ethyl methanesulphonate;   methylsulfonic acid ethyl ester
 xref: CAS:62-50-0;   KEGG:C19239
 xref_mesh: MESH:D005020
 xref: PMID:16039156;   PMID:19797863;   PMID:20102787;   PMID:24475756;   PMID:24524729;   PMID:24531730;   PMID:24728647;   PMID:6936603;   PMID:7285888;   Reaxys:773969;   Wikipedia:Ethyl_methanesulfonate

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      CHEBI ontology 19887
        role 19858
          biological role 19856
            aetiopathogenetic role 19224
              genotoxin 17672
                ethyl methanesulfonate 2177
    Path 2
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      CHEBI ontology 19887
        subatomic particle 19885
          composite particle 19885
            hadron 19885
              baryon 19885
                nucleon 19885
                  atomic nucleus 19885
                    atom 19885
                      main group element atom 19824
                        p-block element atom 19824
                          chalcogen 19580
                            oxygen atom 19551
                              oxygen molecular entity 19551
                                hydroxides 19361
                                  oxoacid 18797
                                    chalcogen oxoacid 13803
                                      sulfur oxoacid 13595
                                        sulfonic acid 11619
                                          sulfo group 9954
                                            organosulfonic acid 9954
                                              alkanesulfonic acid 4010
                                                methanesulfonic acid 4000
                                                  methanesulfonates 3997
                                                    methanesulfonate ester 3996
                                                      ethyl methanesulfonate 2177
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