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ONTOLOGY REPORT - ANNOTATIONS


Term:dimethyl fumarate
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Accession:CHEBI:76004 term browser browse the term
Definition:An enoate ester resulting from the formal condensation of both carboxy groups of fumaric acid with methanol. Used for treatment of adults with relapsing forms of multiple sclerosis.
Synonyms:exact_synonym: dimethyl (2E)-but-2-enedioate
 related_synonym: (E)-But-2-enedioic acid dimethyl ester;   1,2-bis(methoxycarbonyl)-trans-ethylene;   Dimethyl trans-ethylenedicarboxylate;   Formula=C6H8O4;   Fumaric acid, dimethyl ester;   InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+;   InChIKey=LDCRTTXIJACKKU-ONEGZZNKSA-N;   SMILES=COC(=O)\\C=C\\C(=O)OC;   Tecfidera;   trans-1,2-Ethylenedicarboxylic acid dimethyl ester;   trans-Butenedioic acid dimethyl ester
 xref: CAS:624-49-7;   DrugBank:DB08908;   Drug_Central:4757;   HMDB:HMDB0031257;   KEGG:D03846
 xref_mesh: MESH:C056020
 xref: PMID:23946617;   PMID:24061646;   PMID:24131282;   Patent:US2008089861;   Patent:WO2011100589;   Reaxys:774590;   Wikipedia:Dimethyl_fumarate


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Term Annotations click to browse term
  CHEBI ontology 856
    role 834
      biological role 834
        immunomodulator 43
          dimethyl fumarate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 856
    subatomic particle 841
      composite particle 841
        hadron 841
          baryon 841
            nucleon 841
              atomic nucleus 841
                atom 841
                  main group element atom 829
                    p-block element atom 826
                      carbon group element atom 799
                        carbon atom 795
                          organic molecular entity 795
                            organic group 373
                              organic divalent group 371
                                organodiyl group 371
                                  carbonyl group 370
                                    carbonyl compound 370
                                      dicarboxylic acids and O-substituted derivatives 13
                                        dicarboxylic acid 13
                                          C4-dicarboxylic acid 7
                                            butenedioic acid 2
                                              fumaric acid 0
                                                dimethyl fumarate 0
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