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CHEBI:129706 - [(1S,2aS,8bS)-1-(hydroxymethyl)-2-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-pyridin-4-ylmethanone

ChEBI IDCHEBI:129706
ChEBI Name[(1S,2aS,8bS)-1-(hydroxymethyl)-2-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-pyridin-4-ylmethanone
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DownloadsMolfile
FormulaC23H20N4O3
Net Charge0
Average Mass400.438
Monoisotopic Mass400.15354
SMILESO=C(c1ccncc1)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2C(=O)c1ccccn1
InChIInChI=1S/C23H20N4O3/c28-14-20-21-16-5-1-2-7-18(16)26(22(29)15-8-11-24-12-9-15)13-19(21)27(20)23(30)17-6-3-4-10-25-17/h1-12,19-21,28H,13-14H2/t19-,20-,21+/m1/s1
InChIKeyIBDAQUBWSFJDHC-NJYVYQBISA-N
ChEBI Ontology
Outgoing Relation(s)
[(1S,2aS,8bS)-1-(hydroxymethyl)-2-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-pyridin-4-ylmethanone (CHEBI:129706) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-41257LINCS