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CHEBI:126889 - (1S,2aS,8bS)-N-(3-chlorophenyl)-1-(hydroxymethyl)-2-[oxo(pyridin-4-yl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide

ChEBI IDCHEBI:126889
ChEBI Name(1S,2aS,8bS)-N-(3-chlorophenyl)-1-(hydroxymethyl)-2-[oxo(pyridin-4-yl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
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DownloadsMolfile
FormulaC24H21ClN4O3
Net Charge0
Average Mass448.910
Monoisotopic Mass448.13022
SMILESO=C(Nc1cccc(Cl)c1)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2C(=O)c1ccncc1
InChIInChI=1S/C24H21ClN4O3/c25-16-4-3-5-17(12-16)27-24(32)28-13-20-22(18-6-1-2-7-19(18)28)21(14-30)29(20)23(31)15-8-10-26-11-9-15/h1-12,20-22,30H,13-14H2,(H,27,32)/t20-,21-,22+/m1/s1
InChIKeyCCCMDIPFDONFPS-VSKRKVRLSA-N
ChEBI Ontology
Outgoing Relation(s)
(1S,2aS,8bS)-N-(3-chlorophenyl)-1-(hydroxymethyl)-2-[oxo(pyridin-4-yl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide (CHEBI:126889) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-38452LINCS