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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:cetyltrimethylammonium ion
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Accession:CHEBI:39561 term browser browse the term
Definition:A quaternary ammonium ion in which the substituents on nitrogen are one hexadecyl and three methyl groups.
Synonyms:exact_synonym: N,N,N-trimethylhexadecan-1-aminium
 related_synonym: CETYL-TRIMETHYL-AMMONIUM;   Cetrimonium;   Cetyltrimethylammonium cation;   Formula=C19H42N;   Hexadecyltrimethylammonium;   Hexadecyltrimethylammonium ion;   InChI=1S/C19H42N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4/h5-19H2,1-4H3/q+1;   InChIKey=RLGQACBPNDBWTB-UHFFFAOYSA-N;   N,N,N-Trimethyl-1-hexadecanaminium;   SMILES=CCCCCCCCCCCCCCCC[N+](C)(C)C;   Trimethylhexadecylammonium;   cetyltrimethylammonium;   trimethylhexadecylammonium ion
 xref: Beilstein:1772803;   CAS:6899-10-1;   Drug_Central:3082
 xref_mesh: MESH:D000077286
 xref: PDBeChem:16A;   PMID:11999517;   PMID:18762921;   PMID:24020648;   PMID:5758558;   Reaxys:1772803



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cetyltrimethylammonium ion term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Iyd iodotyrosine deiodinase multiple interactions ISO Cetrimonium inhibits the reaction [IYD protein results in increased metabolism of Monoiodotyrosine] CTD PMID:33352258 NCBI chr 1:40,003,999...40,019,323
Ensembl chr 1:40,004,041...40,019,319
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20069
    chemical entity 20068
      molecular entity 20068
        ion 16477
          organic ion 9208
            organic cation 8143
              quaternary ammonium ion 5130
                cetyltrimethylammonium ion 1
                  cetyltrimethylammonium bromide 0
                  cetyltrimethylammonium chloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20069
    subatomic particle 20068
      composite particle 20068
        hadron 20068
          baryon 20068
            nucleon 20068
              atomic nucleus 20068
                atom 20068
                  main group element atom 19969
                    main group molecular entity 19969
                      s-block molecular entity 19761
                        hydrogen molecular entity 19753
                          hydrides 19115
                            inorganic hydride 17872
                              pnictogen hydride 17855
                                nitrogen hydride 17741
                                  ammonium 8249
                                    ammonium ion derivative 8245
                                      quaternary ammonium ion 5130
                                        cetyltrimethylammonium ion 1
                                          cetyltrimethylammonium bromide 0
                                          cetyltrimethylammonium chloride 0
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