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CHEBI:126027 - (1R,2aR,8bR)-N-(3-fluorophenyl)-1-(hydroxymethyl)-2-[1-oxo-2-(2-pyridinyl)ethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide

ChEBI IDCHEBI:126027
ChEBI Name(1R,2aR,8bR)-N-(3-fluorophenyl)-1-(hydroxymethyl)-2-[1-oxo-2-(2-pyridinyl)ethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
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DownloadsMolfile
FormulaC25H23FN4O3
Net Charge0
Average Mass446.482
Monoisotopic Mass446.17542
SMILESO=C(Nc1cccc(F)c1)N1C[C@H]2[C@@H](c3ccccc31)[C@H](CO)N2C(=O)Cc1ccccn1
InChIInChI=1S/C25H23FN4O3/c26-16-6-5-8-18(12-16)28-25(33)29-14-21-24(19-9-1-2-10-20(19)29)22(15-31)30(21)23(32)13-17-7-3-4-11-27-17/h1-12,21-22,24,31H,13-15H2,(H,28,33)/t21-,22-,24+/m0/s1
InChIKeyPJKYSCCIDOXZLC-WPFOTENUSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,2aR,8bR)-N-(3-fluorophenyl)-1-(hydroxymethyl)-2-[1-oxo-2-(2-pyridinyl)ethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide (CHEBI:126027) is a quinolines (CHEBI:26513)
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