EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:128771 - N-[[(2R,3S,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide

ChEBI IDCHEBI:128771
ChEBI NameN-[[(2R,3S,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide
Stars
DownloadsMolfile
FormulaC22H27N3O4
Net Charge0
Average Mass397.475
Monoisotopic Mass397.20016
SMILESCOCCN(C[C@H]1[C@H](c2ccccc2)[C@H](CO)N1C(C)=O)C(=O)c1cccnc1
InChIInChI=1S/C22H27N3O4/c1-16(27)25-19(21(20(25)15-26)17-7-4-3-5-8-17)14-24(11-12-29-2)22(28)18-9-6-10-23-13-18/h3-10,13,19-21,26H,11-12,14-15H2,1-2H3/t19-,20-,21-/m0/s1
InChIKeyQFILVVKSXIQKON-ACRUOGEOSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2R,3S,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide (CHEBI:128771) is a azetidines (CHEBI:38777)
N-[[(2R,3S,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide (CHEBI:128771) is a benzenes (CHEBI:22712)
N-[[(2R,3S,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide (CHEBI:128771) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-40323LINCS