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CHEBI:73475 - acetyl-β-methylthiocholine

ChEBI IDCHEBI:73475
ChEBI Nameacetyl-β-methylthiocholine
Stars
ASCII Nameacetyl-beta-methylthiocholine
DefinitionA quaternary ammonium ion that is the S-acetyl derivative of β-methylthiocholine
Last Modified15 May 2013
SubmitterMargaret Duesbury
DownloadsMolfile
FormulaC8H18NOS
Net Charge+1
Average Mass176.305
Monoisotopic Mass176.11036
SMILESCC(=O)SC(C)C[N+](C)(C)C
InChIInChI=1S/C8H18NOS/c1-7(11-8(2)10)6-9(3,4)5/h7H,6H2,1-5H3/q+1
InChIKeySHEXQJZFGTZWSV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
acetyl-β-methylthiocholine (CHEBI:73475) is a quaternary ammonium ion (CHEBI:35267)
Incoming Relation(s)
acetyl-β-methylthiocholine iodide (CHEBI:73545) has part acetyl-β-methylthiocholine (CHEBI:73475)
IUPAC Name 
2-(acetylsulfanyl)-N,N,N-trimethylpropan-1-aminium
Synonyms  Source
S-acetyl-β-methylthiocholineChEBI
acetyl-b-methylthiocholineChEBI
Registry NumbersSources
Reaxys:1770057Reaxys
Citations