CHEBI:126061 - N-[[(2S,3R,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide

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ChEBI Name N-[[(2S,3R,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide
ChEBI ID CHEBI:126061
Stars This entity has been manually annotated by a third party.
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Formula C22H27N3O4
Net Charge 0
Average Mass 397.468
Monoisotopic Mass 397.20016
InChI InChI=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-/m1/s1
InChIKey QFILVVKSXIQKON-QHAWAJNXSA-N
SMILES CC(=O)N1[C@@H]([C@H]([C@@H]1CO)C2=CC=CC=C2)CN(CCOC)C(=O)C3=CN=CC=C3
ChEBI Ontology
Outgoing N-[[(2S,3R,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide (CHEBI:126061) is a azetidines (CHEBI:38777)
N-[[(2S,3R,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide (CHEBI:126061) is a benzenes (CHEBI:22712)
N-[[(2S,3R,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-N-(2-methoxyethyl)-3-pyridinecarboxamide (CHEBI:126061) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-37628 LINCS
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