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Accession:CHEBI:59607 term browser browse the term
Definition:A quaternary ammonium salt derived from hexamethylenetetramine; used as a preservative in many cosmetics and industrial substances. Also acts as a disinfectant and allergenic agent.
Synonyms:exact_synonym: 1-[3-chloroprop-2-en-1-yl]-3,5,7-triaza-1-azoniatricyclo[,(7)]decanium chloride
 related_synonym: 1-(3-Chloroallyl)-3,5,7-triaza-1-azoniaadamantane chloride;   1-(3-chloro-2-propenyl)-3,5,7-triaza-1-azoniatricyclo(,7)decane chloride;   CTAC;   Formula=C9H16Cl2N4;   Hexamethylenetetramine chloroallyl chloride;   InChI=1S/C9H16ClN4.ClH/c10-2-1-3-14-7-11-4-12(8-14)6-13(5-11)9-14;/h1-2H,3-9H2;1H/q+1;/p-1;   InChIKey=UKHVLWKBNNSRRR-UHFFFAOYSA-M;   Methenamine 3-chloroallylochloride;   N-(3-Chloroallyl)hexaminium chloride;   SMILES=[Cl-].[H]C(Cl)=C([H])C[N+]12CN3CN(CN(C3)C1)C2
 xref: Beilstein:9300843 "Beilstein";   CAS:4080-31-3 "ChemIDplus";   PMID:15462465 "Europe PMC";   PMID:20433443 "Europe PMC";   PMID:20448270 "Europe PMC";   PMID:21616561 "Europe PMC";   PMID:22653068 "Europe PMC";   PMID:26821003 "Europe PMC"

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  CHEBI ontology 19716
    role 19663
      biological role 19661
        hapten 2975
          quaternium-15 0
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  CHEBI ontology 19716
    subatomic particle 19712
      composite particle 19712
        hadron 19712
          baryon 19712
            nucleon 19712
              atomic nucleus 19712
                atom 19712
                  main group element atom 19598
                    main group molecular entity 19598
                      s-block molecular entity 19361
                        hydrogen molecular entity 19350
                          hydrides 18280
                            inorganic hydride 17204
                              pnictogen hydride 17166
                                nitrogen hydride 17003
                                  azane 16693
                                    ammonia 16690
                                      organic amino compound 16689
                                        polyamine 8076
                                          tetramine 185
                                            hexamethylenetetramine 0
                                              quaternium-15 0
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