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ONTOLOGY REPORT - ANNOTATIONS


Term:mirabegron
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Accession:CHEBI:65349 term browser browse the term
Definition:A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 2-amino-1,3-thiazol-4-ylacetic acid with the anilino group of (1R)-2-{[2-(4-aminophenyl)ethyl]amino}-1-phenylethanol. Used for the treatment of overactive bladder syndrome.
Synonyms:exact_synonym: 2-(2-amino-1,3-thiazol-4-yl)-N-[4-(2-{[(2R)-2-hydroxy-2-phenylethyl]amino}ethyl)phenyl]acetamide
 related_synonym: Formula=C21H24N4O2S;   InChI=1S/C21H24N4O2S/c22-21-25-18(14-28-21)12-20(27)24-17-8-6-15(7-9-17)10-11-23-13-19(26)16-4-2-1-3-5-16/h1-9,14,19,23,26H,10-13H2,(H2,22,25)(H,24,27)/t19-/m0/s1;   InChIKey=PBAPPPCECJKMCM-IBGZPJMESA-N;   Myrbetriq;   SMILES=Nc1nc(CC(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)cs1
 xref: CAS:223673-61-8 "ChemIDplus";   CAS:223673-61-8 "KEGG DRUG";   Drug_Central:4382 "DrugCentral";   KEGG:D09535;   PMID:20878594 "Europe PMC";   PMID:21142693 "Europe PMC";   PMID:21510978 "Europe PMC";   PMID:22269146 "Europe PMC";   PMID:22317789 "Europe PMC";   PMID:22384458 "Europe PMC";   PMID:22411211 "Europe PMC";   PMID:22430195 "Europe PMC";   PMID:22509825 "Europe PMC";   PMID:22687876 "Europe PMC";   PMID:22691895 "Europe PMC";   PMID:22734512 "Europe PMC";   PMID:22734513 "Europe PMC";   PMID:22821779 "Europe PMC";   Patent:EP1559427;   Patent:EP2119700;   Reaxys:11023250 "Reaxys"


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  CHEBI ontology 0
    role 0
      application 0
        refrigerant 0
          ammonia 0
            organic amino compound 0
              amino alcohol 0
                ethanolamines 0
                  mirabegron 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
                            organic group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      carboxylic acid 0
                                        carboacyl group 0
                                          univalent carboacyl group 0
                                            carbamoyl group 0
                                              carboxamide 0
                                                monocarboxylic acid amide 0
                                                  mirabegron 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.