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CHEBI:126985 - [(3aS,4R,9bS)-8-(2-fluorophenyl)-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone

ChEBI IDCHEBI:126985
ChEBI Name[(3aS,4R,9bS)-8-(2-fluorophenyl)-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone
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DownloadsMolfile
FormulaC25H22F2N2O2
Net Charge0
Average Mass420.459
Monoisotopic Mass420.16493
SMILESO=C(c1cccc(F)c1)N1CC[C@H]2[C@H](CO)Nc3ccc(-c4ccccc4F)cc3[C@H]21
InChIInChI=1S/C25H22F2N2O2/c26-17-5-3-4-16(12-17)25(31)29-11-10-19-23(14-30)28-22-9-8-15(13-20(22)24(19)29)18-6-1-2-7-21(18)27/h1-9,12-13,19,23-24,28,30H,10-11,14H2/t19-,23-,24-/m0/s1
InChIKeyCLIVIFLLNNUVCZ-IGKWTDBASA-N
ChEBI Ontology
Outgoing Relation(s)
[(3aS,4R,9bS)-8-(2-fluorophenyl)-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone (CHEBI:126985) is a quinolines (CHEBI:26513)
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