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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > piperazines > n-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > piperazines > n-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > piperazines > n-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > piperazines > n-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide

Preferred term

n-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]benzamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C25H31N3O4

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

mass

  • 437.532

monoisotopicmass

  • 437.23146

smiles

  • C1C[C@@H]([C@H](O[C@@H]1CC(=O)N2CCN(CC2)C3=CC=CC=C3)CO)NC(=O)C4=CC=CC=C4

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118004

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