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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:acetyl-beta-methylthiocholine iodide
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Accession:CHEBI:73545 term browser browse the term
Definition:A quaternary ammonium salt that is the monoiodide salt of acetyl-beta-methylthiocholine.
Synonyms:exact_synonym: 2-(acetylsulfanyl)-N,N,N-trimethylpropan-1-aminium iodide
 related_synonym: 2-Acetylthiopropyltrimethylammonium iodide;   Formula=C8H18INOS;   InChI=1S/C8H18NOS.HI/c1-7(11-8(2)10)6-9(3,4)5;/h7H,6H2,1-5H3;1H/q+1;/p-1;   InChIKey=XFWLTEMLPVNWIJ-UHFFFAOYSA-M;   S-acetyl-beta-methylthiocholine iodide;   SMILES=[I-].CC(C[N+](C)(C)C)SC(C)=O;   acetyl-b-methylthiocholine iodide
 xref: CAS:1866-17-7;   PMID:23597562;   Reaxys:3917049


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Term Annotations click to browse term
  CHEBI ontology 19831
    chemical entity 19829
      molecular entity 19829
        ion 16707
          organic ion 9870
            organic cation 8919
              quaternary ammonium ion 5273
                quaternary ammonium salt 537
                  acetyl-beta-methylthiocholine iodide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    main group molecular entity 19779
                      s-block molecular entity 19617
                        hydrogen molecular entity 19604
                          hydrides 19102
                            inorganic hydride 18114
                              pnictogen hydride 18103
                                nitrogen hydride 18010
                                  ammonium 8311
                                    ammonium ion derivative 8306
                                      ammonium compound 5195
                                        organoammonium salt 655
                                          quaternary ammonium salt 537
                                            acetyl-beta-methylthiocholine iodide 0
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