EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:129155 - (1R,2aS,8bS)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-N-phenyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide

ChEBI IDCHEBI:129155
ChEBI Name(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-N-phenyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide
Stars
DownloadsMolfile
FormulaC26H25N3O4
Net Charge0
Average Mass443.503
Monoisotopic Mass443.18451
SMILESCOc1ccccc1C(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2C(=O)Nc1ccccc1
InChIInChI=1S/C26H25N3O4/c1-33-23-14-8-6-12-19(23)25(31)28-15-21-24(18-11-5-7-13-20(18)28)22(16-30)29(21)26(32)27-17-9-3-2-4-10-17/h2-14,21-22,24,30H,15-16H2,1H3,(H,27,32)/t21-,22+,24+/m1/s1
InChIKeyCLVZMKYRVQCIMH-GPXNEJASSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-N-phenyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide (CHEBI:129155) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-40706LINCS