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CHEBI:196096 - tert-Butylbicyclophosphorothionate

ChEBI IDCHEBI:196096
ChEBI Nametert-Butylbicyclophosphorothionate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC8H15O3PS
Net Charge0
Average Mass222.246
Monoisotopic Mass222.04795
SMILESCC(C)(C)C12COP(=S)(OC1)OC2
InChIInChI=1S/C8H15O3PS/c1-7(2,3)8-4-9-12(13,10-5-8)11-6-8/h4-6H2,1-3H3
InChIKeyVTBHBNXGFPTBJL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
tert-Butylbicyclophosphorothionate (CHEBI:196096) is a organic thiophosphate (CHEBI:37512)
IUPAC Name 
4-tert-butyl-1-sulanylidene-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octane
Manual XrefsDatabases
HMDB0258754HMDB
C19930KEGG COMPOUND
94586ChemSpider