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CHEBI:129753 - (1R,2aS,8bS)-N-(2,5-difluorophenyl)-1-(hydroxymethyl)-2-(3-pyridinylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide

ChEBI IDCHEBI:129753
ChEBI Name(1R,2aS,8bS)-N-(2,5-difluorophenyl)-1-(hydroxymethyl)-2-(3-pyridinylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
Stars
DownloadsMolfile
FormulaC24H22F2N4O2
Net Charge0
Average Mass436.462
Monoisotopic Mass436.17108
SMILESO=C(Nc1cc(F)ccc1F)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2Cc1cccnc1
InChIInChI=1S/C24H22F2N4O2/c25-16-7-8-18(26)19(10-16)28-24(32)30-13-21-23(17-5-1-2-6-20(17)30)22(14-31)29(21)12-15-4-3-9-27-11-15/h1-11,21-23,31H,12-14H2,(H,28,32)/t21-,22+,23+/m1/s1
InChIKeyFGRNHJGXTXXJTE-VJBWXMMDSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,2aS,8bS)-N-(2,5-difluorophenyl)-1-(hydroxymethyl)-2-(3-pyridinylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide (CHEBI:129753) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-41304LINCS