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CHEBI:126044 - [(1R,2aR,8bR)-1-(hydroxymethyl)-2-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-pyridin-4-ylmethanone

ChEBI IDCHEBI:126044
ChEBI Name[(1R,2aR,8bR)-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+/m0/s1
InChIKeyIBDAQUBWSFJDHC-PCCBWWKXSA-N
ChEBI Ontology
Outgoing Relation(s)
[(1R,2aR,8bR)-1-(hydroxymethyl)-2-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-pyridin-4-ylmethanone (CHEBI:126044) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-37611LINCS