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Concept information

Preferred term

N [(2S,3R,6R) 6 [2 (4 benzylpiperidin 1 yl) 2 oxoethyl] 2 (hydroxymethyl)oxan 3 yl] 4 methoxybenzenesulfonamide  

Type

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

Broader concept

charge

  • 0

formula

  • C27H36N2O6S

inchi

  • InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26-/m1/s1

inchikey

  • JXWMWOXWMMUZLT-LGPLSSKUSA-N

mass

  • 516.652

monoisotopicmass

  • 516.22941

smiles

  • COC1=CC=C(C=C1)S(=O)(=O)N[C@@H]2CC[C@@H](O[C@@H]2CO)CC(=O)N3CCC(CC3)CC4=CC=CC=C4

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:98355

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