CHEBI:118004 - N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide

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ChEBI Name N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide
ChEBI ID CHEBI:118004
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H31N3O4
Net Charge 0
Average Mass 437.532
Monoisotopic Mass 437.23146
InChI InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23+/m0/s1
InChIKey AVWHUTQXLFJWQV-RJGXRXQPSA-N
SMILES C1C[C@@H]([C@H](O[C@@H]1CC(=O)N2CCN(CC2)C3=CC=CC=C3)CO)NC(=O)C4=CC=CC=C4
ChEBI Ontology
Outgoing N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide (CHEBI:118004) is a piperazines (CHEBI:26144)
Manual Xref Database
LSM-29453 LINCS
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