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CHEBI:127449 - (1S,2aR,8bR)-N-(2,5-difluorophenyl)-1-(hydroxymethyl)-2-(2-methoxy-1-oxoethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide

ChEBI IDCHEBI:127449
ChEBI Name(1S,2aR,8bR)-N-(2,5-difluorophenyl)-1-(hydroxymethyl)-2-(2-methoxy-1-oxoethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
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DownloadsMolfile
FormulaC21H21F2N3O4
Net Charge0
Average Mass417.412
Monoisotopic Mass417.15001
SMILESCOCC(=O)N1[C@H](CO)[C@@H]2c3ccccc3N(C(=O)Nc3cc(F)ccc3F)C[C@@H]21
InChIInChI=1S/C21H21F2N3O4/c1-30-11-19(28)26-17-9-25(21(29)24-15-8-12(22)6-7-14(15)23)16-5-3-2-4-13(16)20(17)18(26)10-27/h2-8,17-18,20,27H,9-11H2,1H3,(H,24,29)/t17-,18+,20+/m0/s1
InChIKeyVUMKAXCAFCSXAP-NLWGTHIKSA-N
ChEBI Ontology
Outgoing Relation(s)
(1S,2aR,8bR)-N-(2,5-difluorophenyl)-1-(hydroxymethyl)-2-(2-methoxy-1-oxoethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide (CHEBI:127449) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
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