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CHEBI:80916 - Tyrindoxyl sulfate

ChEBI IDCHEBI:80916
ChEBI NameTyrindoxyl sulfate
Stars
DownloadsMolfile
FormulaC9H8BrNO4S2
Net Charge0
Average Mass338.204
Monoisotopic Mass336.90781
SMILESCSc1nc2cc(Br)ccc2c1OS(=O)(=O)O
InChIInChI=1S/C9H8BrNO4S2/c1-16-9-8(15-17(12,13)14)6-3-2-5(10)4-7(6)11-9/h2-4,11H,1H3,(H,12,13,14)
InChIKeySATFYAMEGITBTG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Tyrindoxyl sulfate (CHEBI:80916) is a indoles (CHEBI:24828)
Manual XrefsDatabases
C17086KEGG COMPOUND
Registry NumbersSources
CAS:74626-31-6KEGG COMPOUND