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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:lauryl sulfobetaine
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Accession:CHEBI:75303 term browser browse the term
Definition:An ammonium betaine in which the ammonium nitrogen is substituted by dodecyl, 3-sulfatopropyl and two methyl groups.
Synonyms:exact_synonym: 3-[dodecyl(dimethyl)azaniumyl]propane-1-sulfonate
 related_synonym: 3-(N,N-dimethyldodecylammonio)propanesulfonate;   3-(N,N-dimethyllaurylammonio)propanesulfonate;   3-(dodecyldimethylammonio)propanesulfonate;   3-(lauryldimethylammonio)propanesulfonate;   Formula=C17H37NO3S;   InChI=1S/C17H37NO3S/c1-4-5-6-7-8-9-10-11-12-13-15-18(2,3)16-14-17-22(19,20)21/h4-17H2,1-3H3;   InChIKey=IZWSFJTYBVKZNK-UHFFFAOYSA-N;   Lauryl sultaine;   N,N-Dimethyl-N-(3-sulfopropyl)-1-dodecanaminium hydroxide inner salt;   N-Dodecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate;   SB3-12;   SMILES=CCCCCCCCCCCC[N+](C)(C)CCCS([O-])(=O)=O;   dodecyl sulfobetaine;   dodecyldimethyl(3-sulphonatopropyl)ammonium;   zwittergent 3-12
 xref: CAS:14933-08-5;   Chemspider:76413;   MetaCyc:CPD-10672;   PMID:19072857;   PMID:20572645;   PMID:22736477;   PMID:2625482;   Patent:WO2005065708;   Patent:WO2012160187;   Reaxys:4145308
 cyclic_relationship: is_conjugate_base_of CHEBI:41362


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  CHEBI ontology 19880
    role 19850
      application 19695
        detergent 3656
          lauryl sulfobetaine 0
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  CHEBI ontology 19880
    subatomic particle 19878
      composite particle 19878
        hadron 19878
          baryon 19878
            nucleon 19878
              atomic nucleus 19878
                atom 19878
                  main group element atom 19817
                    main group molecular entity 19817
                      s-block molecular entity 19653
                        hydrogen molecular entity 19634
                          hydrides 19144
                            inorganic hydride 18161
                              pnictogen hydride 18151
                                nitrogen hydride 18064
                                  ammonium 8310
                                    ammonium ion derivative 8305
                                      quaternary ammonium ion 5294
                                        quaternary nitrogen compound 880
                                          ammonium betaine 370
                                            lauryl sulfobetaine 0
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