CHEBI:130097 - 1-[(1S,2aR,8bR)-2-[(2-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone

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ChEBI Name 1-[(1S,2aR,8bR)-2-[(2-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone
ChEBI ID CHEBI:130097
Stars This entity has been manually annotated by a third party.
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Formula C21H21FN2O4
Net Charge 0
Average Mass 384.402
Monoisotopic Mass 384.14854
InChI InChI=1S/C21H21FN2O4/c1-28-12-19(26)23-10-17-20(14-7-3-5-9-16(14)23)18(11-25)24(17)21(27)13-6-2-4-8-15(13)22/h2-9,17-18,20,25H,10-12H2,1H3/t17-,18+,20+/m0/s1
InChIKey FNVQGPHQAOFVNP-NLWGTHIKSA-N
SMILES COCC(=O)N1C[C@H]2[C@H]([C@H](N2C(=O)C3=CC=CC=C3F)CO)C4=CC=CC=C41
ChEBI Ontology
Outgoing 1-[(1S,2aR,8bR)-2-[(2-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone (CHEBI:130097) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-41647 LINCS
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