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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 19867
    role 19837
      application 19682
        detergent 3659
          lauryl sulfobetaine 0
Path 2
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  CHEBI ontology 19867
    subatomic particle 19865
      composite particle 19865
        hadron 19865
          baryon 19865
            nucleon 19865
              atomic nucleus 19865
                atom 19865
                  main group element atom 19803
                    main group molecular entity 19803
                      s-block molecular entity 19638
                        hydrogen molecular entity 19620
                          hydrides 19141
                            inorganic hydride 18156
                              pnictogen hydride 18146
                                nitrogen hydride 18059
                                  ammonium 8307
                                    ammonium ion derivative 8302
                                      quaternary ammonium ion 5294
                                        quaternary nitrogen compound 880
                                          ammonium betaine 370
                                            lauryl sulfobetaine 0
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