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Term:pentamidine isethionate
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Accession:CHEBI:7977 term browser browse the term
Definition:An organosulfonate salt obtained by reaction of pentamidine with two equivalents of 2-hydroxyethylsulfonic acid.
Synonyms:exact_synonym: 4,4'-[pentane-1,5-diylbis(oxy)]dibenzenecarboximidamide bis(2-hydroxyethylsulfonate)
 related_synonym: 4,4'-(Pentamethylenedioxy)dibenzamidine bis(2-hydroxyethanesulfonate);   4,4'-(Pentane-1,5-diylbis(oxy))dibenzimidamide bis(2-hydroxyethanesulfonate);   4,4'-Diamidino-alpha,omega-diphenoxypentane isethionate;   4,4'-Diamidinodiphenoxypentane di(beta-hydroxyethanesulfonate);   Formula=C23H36N4O10S2;   InChI=1S/C19H24N4O2.2C2H6O4S/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23;2*3-1-2-7(4,5)6/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23);2*3H,1-2H2,(H,4,5,6);   InChIKey=YBVNFKZSMZGRAD-UHFFFAOYSA-N;   Pentamidine diisethionate;   SMILES=OCCS(O)(=O)=O.OCCS(O)(=O)=O.NC(=N)c1ccc(OCCCCCOc2ccc(cc2)C(N)=N)cc1;   [pentane-1,5-diylbis(oxy-4,1-phenylene)]bis(aminomethaniminium) bis(2-hydroxyethanesulfonate);   p,p'-(Pentamethylenedioxy)dibenzamidine bis(beta-hydroxyethanesulfonate)
 xref: CAS:140-64-7 "ChemIDplus";   CAS:140-64-7 "KEGG DRUG";   DrugBank:DB00738;   KEGG:D00834;   PMID:1589716 "Europe PMC";   PMID:18155842 "Europe PMC";   PMID:18349360 "Europe PMC";   PMID:18408970 "Europe PMC";   PMID:18509543 "Europe PMC";   PMID:18833075 "Europe PMC";   PMID:19125672 "Europe PMC";   PMID:19126051 "Europe PMC";   PMID:19208882 "Europe PMC";   PMID:19356780 "Europe PMC";   PMID:19361701 "Europe PMC";   PMID:22271285 "Europe PMC";   PMID:22281895 "Europe PMC";   Reaxys:4286775 "Reaxys"

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Term Annotations click to browse term
  CHEBI ontology 19764
    role 19711
      biological role 19710
        antimicrobial agent 17242
          antimicrobial drug 6138
            antiprotozoal drug 3746
              trypanocidal drug 74
                pentamidine isethionate 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
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic ion 8106
                              organic cation 7115
                                iminium ion 50
                                  carboxamidinium ion 2
                                    pentamidinium(2+) 0
                                      pentamidine isethionate 0
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