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Concept information

Preferred term

2-[(2s,5r,6s)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]-n-(2-pyridin-4-ylethyl)acetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C21H26FN3O5S

inchi

  • InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20+/m0/s1

inchikey

  • DSHMBJFFZMCEDJ-DFQSSKMNSA-N

mass

  • 451.514

monoisotopicmass

  • 451.15772

smiles

  • C1C[C@H]([C@H](O[C@@H]1CC(=O)NCCC2=CC=NC=C2)CO)NS(=O)(=O)C3=CC=C(C=C3)F

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118433

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