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ONTOLOGY REPORT - ANNOTATIONS


Term:pibutidine hydrochloride
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Accession:CHEBI:32000 term browser browse the term
Definition:The hydrochloride salt of pibutidine. It is a H2 receptor antagonist which was developed for the treatment of peptic ulcers and duodenal ulcers. It was in phase III clinical trials in Japan (now discontinued).
Synonyms:exact_synonym: 3-amino-4-{[(2Z)-4-{[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxy}but-2-en-1-yl]amino}cyclobut-3-ene-1,2-dione hydrochloride
 related_synonym: 3-amino-4-[4-[4-(1-piperidinomethyl)-2-pyridyloxy]-cis-2- butenylamino]-3-cyclobutene-1,2-dione hydrochloride;   Formula=C19H24N4O3.ClH;   IT 066;   InChI=1S/C19H24N4O3.ClH/c20-16-17(19(25)18(16)24)22-7-2-5-11-26-15-12-14(6-8-21-15)13-23-9-3-1-4-10-23;/h2,5-6,8,12,22H,1,3-4,7,9-11,13,20H2;1H/b5-2-;;   InChIKey=ODBOENMSSFCACZ-PVOKDAACSA-N;   SMILES=Cl.C1CCN(CC1)CC2=CC(=NC=C2)OC/C=C\\CNC=3C(C(C3N)=O)=O;   pibutidine HCl;   pibutidine monohydrochloride
 xref: CAS:126463-66-9 "ChemIDplus";   KEGG:D01861;   PMID:10759252 "Europe PMC";   PMID:11130203 "Europe PMC";   PMID:1686058 "Europe PMC";   PMID:1971169 "Europe PMC";   PMID:1971222 "Europe PMC";   PMID:1972370 "Europe PMC";   PMID:1979811 "Europe PMC";   PMID:8658031 "Europe PMC";   PMID:9467826 "Europe PMC";   PMID:9730007 "Europe PMC"


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Term Annotations click to browse term
  CHEBI ontology 19764
    role 19711
      application 19362
        pharmaceutical 19231
          drug 19231
            anti-ulcer drug 753
              pibutidine hydrochloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    main group molecular entity 19646
                      s-block molecular entity 19408
                        hydrogen molecular entity 19397
                          hydrides 18357
                            inorganic hydride 17210
                              pnictogen hydride 17174
                                nitrogen hydride 17008
                                  ammonium 8219
                                    ammonium ion derivative 8214
                                      piperidinium ion 39
                                        pibutidine(1+) 0
                                          pibutidine hydrochloride 0
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