CHEBI:73475 - acetyl-β-methylthiocholine

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ChEBI Name acetyl-β-methylthiocholine ChEBI ID CHEBI:73475 ChEBI ASCII Name acetyl-beta-methylthiocholine Definition A quaternary ammonium ion that is the S-acetyl derivative of β-methylthiocholine Stars This entity has been manually annotated by the ChEBI Team. Submitter Margaret Duesbury Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H18NOS Net Charge +1 Average Mass 176.30000 Monoisotopic Mass 176.11036 InChI InChI=1S/C8H18NOS/c1-7(11-8(2)10)6-9(3,4)5/h7H,6H2,1-5H3/q+1 InChIKey SHEXQJZFGTZWSV-UHFFFAOYSA-N SMILES CC(C[N+](C)(C)C)SC(C)=O ChEBI Ontology Outgoing acetyl-β-methylthiocholine (CHEBI:73475) is a quaternary ammonium ion (CHEBI:35267) Incoming acetyl-β-methylthiocholine iodide (CHEBI:73545) has part acetyl-β-methylthiocholine (CHEBI:73475) IUPAC Name 2-(acetylsulfanyl)-N,N,N-trimethylpropan-1-aminium Synonyms Sources acetyl-b-methylthiocholine ChEBI S-acetyl-β-methylthiocholine ChEBI Registry Number Type Source 1770057 Reaxys Registry Number Reaxys Citations Types Sources 23597562 PubMed citation Europe PMC 5384471 PubMed citation Europe PMC Last Modified 15 May 2013