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CHEBI:755698 - nt-219

Default Structure
ChEBI IDCHEBI:755698
ChEBI Nament-219
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC16H14BrNO5S
Net Charge0
Average Mass412.261
Monoisotopic Mass410.97761
SMILESOc1cc(CNC(=S)/C=C/c2ccc(O)c(O)c2Br)cc(O)c1O
InChIInChI=1S/C16H14BrNO5S/c17-14-9(1-3-10(19)16(14)23)2-4-13(24)18-7-8-5-11(20)15(22)12(21)6-8/h1-6,19-23H,7H2,(H,18,24)/b4-2+
InChIKeyXDDQKKXXQHUUHJ-DUXPYHPUSA-N
ChEBI Ontology
Outgoing Relation(s)
nt-219 (CHEBI:755698) is a benzenetriol (CHEBI:22707)
Synonyms  Source
NT-219ChEMBL
NT219ChEMBL