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CHEBI:135033 - vanitiolide

ChEBI IDCHEBI:135033
ChEBI Namevanitiolide
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC12H15NO3S
Net Charge0
Average Mass253.323
Monoisotopic Mass253.07726
SMILESCOc1cc(C(=S)N2CCOCC2)ccc1O
InChIInChI=1S/C12H15NO3S/c1-15-11-8-9(2-3-10(11)14)12(17)13-4-6-16-7-5-13/h2-3,8,14H,4-7H2,1H3
InChIKeyWQYRHRAZNNRDIA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
vanitiolide (CHEBI:135033) is a methoxybenzenes (CHEBI:51683)
vanitiolide (CHEBI:135033) is a phenols (CHEBI:33853)
Synonym  Source
vanitiolidDrugCentral
Manual XrefsDatabases
3847DrugCentral
Registry NumbersSources
CAS:17692-71-6DrugCentral