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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:bumetanide
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Accession:CHEBI:3213 term browser browse the term
Definition:A member of the class of benzoic acids that is 4-phenoxybenzoic acid in which the hydrogens ortho to the phenoxy group are substituted by butylamino and sulfamoyl groups. Bumetanide is a diuretic, and is used for treatment of oedema associated with congestive heart failure, hepatic and renal disease.
Synonyms:related_synonym: 3-(aminosulfonyl)-5-(butylamino)-4-phenoxybenzoic acid;   3-butylamino-4-phenoxy-5-sulfamoyl-benzoic acid;   3-butylamino-4-phenoxy-5-sulfamoylbenzoic acid;   Formula=C17H20N2O5S;   InChI=1S/C17H20N2O5S/c1-2-3-9-19-14-10-12(17(20)21)11-15(25(18,22)23)16(14)24-13-7-5-4-6-8-13/h4-8,10-11,19H,2-3,9H2,1H3,(H,20,21)(H2,18,22,23);   InChIKey=MAEIEVLCKWDQJH-UHFFFAOYSA-N;   SMILES=CCCCNc1cc(cc(c1Oc1ccccc1)S(N)(=O)=O)C(O)=O;   bumetanida;   bumetanidum
 alt_id: CHEBI:239281
 xref: Beilstein:2185351;   CAS:28395-03-1;   DrugBank:DB00887;   Drug_Central:427;   HMDB:HMDB0015024;   KEGG:D00247;   LINCS:LSM-2848
 xref_mesh: MESH:D002034
 xref: PMID:18374572;   PMID:19454284;   PMID:28166217;   PMID:3989818;   Patent:DE1964503;   Patent:DE1964504;   Patent:US3806534;   Reaxys:2185351;   Wikipedia:Bumetanide

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  CHEBI ontology 0
    role 0
      application 0
        pharmaceutical 0
          drug 0
            diuretic 0
              bumetanide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      aromatic carboxylic acid 0
                                        benzoic acids 0
                                          bumetanide 0
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