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CHEBI:120043 - 5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-1-cyclohexyl-2-oxo-3-pyridinecarbonitrile

ChEBI IDCHEBI:120043
ChEBI Name5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-1-cyclohexyl-2-oxo-3-pyridinecarbonitrile
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FormulaC19H17BrN2O3
Net Charge0
Average Mass401.260
Monoisotopic Mass400.04225
SMILESN#Cc1cc(C(=O)c2cc(Br)ccc2O)cn(C2CCCCC2)c1=O
InChIInChI=1S/C19H17BrN2O3/c20-14-6-7-17(23)16(9-14)18(24)13-8-12(10-21)19(25)22(11-13)15-4-2-1-3-5-15/h6-9,11,15,23H,1-5H2
InChIKeyWTAVOSVJMMSCTR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-1-cyclohexyl-2-oxo-3-pyridinecarbonitrile (CHEBI:120043) is a aromatic ketone (CHEBI:76224)
Manual XrefsDatabases
LSM-31486LINCS