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CHEBI:101536 - N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3-oxanyl]-4-methoxybenzenesulfonamide

ChEBI IDCHEBI:101536
ChEBI NameN-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3-oxanyl]-4-methoxybenzenesulfonamide
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DownloadsMolfile
FormulaC27H36N2O6S
Net Charge0
Average Mass516.660
Monoisotopic Mass516.22941
SMILESCOc1ccc(S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO)cc1
InChIInChI=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+/m0/s1
InChIKeyJXWMWOXWMMUZLT-SKBVVQJISA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3-oxanyl]-4-methoxybenzenesulfonamide (CHEBI:101536) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-12899LINCS