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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:NDSB 221
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Accession:CHEBI:63318 term browser browse the term
Definition:An ammonium betaine derivative of 3-(piperidin-1-yl)propane-1-sulfonic acid. One of a group of non-detergent sulfobetaines having a sulfobetaine hydrophilic group and a short hydrophobic group that cannot aggregate to form micelles.
Synonyms:exact_synonym: 3-(1-methylpiperidinium-1-yl)propane-1-sulfonate
 related_synonym: 3-(1-methylpiperidinio)-1-propanesulfonate;   3-(1-methylpiperidinium)-1-propane sulfonate;   Formula=C9H19NO3S;   InChI=1S/C9H19NO3S/c1-10(6-3-2-4-7-10)8-5-9-14(11,12)13/h2-9H2,1H3;   InChIKey=DQNQWAVIDNVATL-UHFFFAOYSA-N;   SMILES=C[N+]1(CCCCC1)CCCS([O-])(=O)=O;   non detergent sulfobetaine 221
 xref: CAS:160788-56-7


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Path 1
Term Annotations click to browse term
  CHEBI ontology 22178
    chemical entity 22208
      molecular entity 22169
        ion 17696
          organic ion 10063
            organic cation 9099
              quaternary ammonium ion 5407
                quaternary nitrogen compound 886
                  ammonium betaine 360
                    NDSB 221 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22178
    subatomic particle 22170
      composite particle 22170
        hadron 22201
          baryon 22170
            nucleon 22170
              atomic nucleus 22170
                atom 22170
                  main group element atom 22104
                    main group molecular entity 22104
                      s-block molecular entity 21729
                        hydrogen molecular entity 21646
                          hydrides 20758
                            inorganic hydride 18672
                              pnictogen hydride 18652
                                nitrogen hydride 18519
                                  ammonium 8211
                                    ammonium ion derivative 8196
                                      quaternary ammonium ion 5407
                                        quaternary nitrogen compound 886
                                          ammonium betaine 360
                                            NDSB 221 0
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