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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:gabexate methanesulfonate
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Accession:CHEBI:31641 term browser browse the term
Synonyms:related_synonym: Formula=C16H24N3O4.CH3O3S;   Formula=C17H27N3O7S;   Gabexate mesilate;   Gabexate monomethanesulfonate;   InChI=1S/C16H23N3O4.CH4O3S/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18;1-5(2,3)4/h7-10H,2-6,11H2,1H3,(H4,17,18,19);1H3,(H,2,3,4);   InChIKey=DNTNDFLIKUKKOC-UHFFFAOYSA-N;   SMILES=C1(=CC=C(C=C1)C(OCC)=O)OC(CCCCCNC(N)=N)=O.S(=O)(=O)(C)O
 xref: CAS:56974-61-9;   KEGG:D01672


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gabexate methanesulfonate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Tnf tumor necrosis factor decreases expression EXP gabexate mesilate decreases expression of Tnf protein in serum RGD PMID:15830285 RGD:10450531 NCBI chr20:5,189,382...5,192,000
Ensembl chr20:5,189,390...5,192,000
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Term Annotations click to browse term
  CHEBI ontology 19853
    chemical entity 19853
      atom 19851
        nonmetal atom 19733
          nitrogen atom 18620
            nitrogen molecular entity 18620
              organonitrogen compound 18395
                guanidines 2174
                  gabexate methanesulfonate 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19853
    subatomic particle 19851
      composite particle 19851
        hadron 19851
          baryon 19851
            nucleon 19851
              atomic nucleus 19851
                atom 19851
                  main group element atom 19744
                    p-block element atom 19744
                      chalcogen 19438
                        oxygen atom 19400
                          oxygen molecular entity 19400
                            hydroxides 19123
                              oxoacid 18256
                                chalcogen oxoacid 11493
                                  sulfur oxoacid 11097
                                    sulfonic acid 7345
                                      sulfo group 5741
                                        organosulfonic acid 5741
                                          alkanesulfonic acid 3978
                                            methanesulfonic acid 3967
                                              methanesulfonates 3964
                                                methanesulfonate salt 1
                                                  gabexate methanesulfonate 1
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