EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:121584 - 3-[[[1-[(4-fluorophenyl)methyl]-5-tetrazolyl]methyl-(2-hydroxyethyl)amino]methyl]-7-methyl-1H-quinolin-2-one

ChEBI IDCHEBI:121584
ChEBI Name3-[[[1-[(4-fluorophenyl)methyl]-5-tetrazolyl]methyl-(2-hydroxyethyl)amino]methyl]-7-methyl-1H-quinolin-2-one
Stars
DownloadsMolfile
FormulaC22H23FN6O2
Net Charge0
Average Mass422.464
Monoisotopic Mass422.18665
SMILESCc1ccc2cc(CN(CCO)Cc3nnnn3Cc3ccc(F)cc3)c(=O)nc2c1
InChIInChI=1S/C22H23FN6O2/c1-15-2-5-17-11-18(22(31)24-20(17)10-15)13-28(8-9-30)14-21-25-26-27-29(21)12-16-3-6-19(23)7-4-16/h2-7,10-11,30H,8-9,12-14H2,1H3,(H,24,31)
InChIKeyGNLUMNUWMHGOMG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[[[1-[(4-fluorophenyl)methyl]-5-tetrazolyl]methyl-(2-hydroxyethyl)amino]methyl]-7-methyl-1H-quinolin-2-one (CHEBI:121584) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-33027LINCS