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CHEBI:128194 - 1-[(1S,2aS,8bS)-2-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone

ChEBI IDCHEBI:128194
ChEBI Name1-[(1S,2aS,8bS)-2-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone
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DownloadsMolfile
FormulaC26H23FN2O3
Net Charge0
Average Mass430.479
Monoisotopic Mass430.16927
SMILESO=C(Cc1ccccc1)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2C(=O)c1cccc(F)c1
InChIInChI=1S/C26H23FN2O3/c27-19-10-6-9-18(14-19)26(32)29-22-15-28(24(31)13-17-7-2-1-3-8-17)21-12-5-4-11-20(21)25(22)23(29)16-30/h1-12,14,22-23,25,30H,13,15-16H2/t22-,23-,25+/m1/s1
InChIKeyIRGPAELJLNMAJN-OYRHQHFDSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(1S,2aS,8bS)-2-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone (CHEBI:128194) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-39749LINCS