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CHEBI:101737 - N-[2-[(2S,5S,6R)-5-[(4-chlorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-1,3-benzodioxole-5-carboxamide

ChEBI IDCHEBI:101737
ChEBI NameN-[2-[(2S,5S,6R)-5-[(4-chlorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-1,3-benzodioxole-5-carboxamide
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FormulaC22H25ClN2O7S
Net Charge0
Average Mass496.969
Monoisotopic Mass496.10710
SMILESO=C(NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1)c1ccc2c(c1)OCO2
InChIInChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21-/m0/s1
InChIKeyWVRHSCPXBJSNMQ-MDKPJZGXSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[2-[(2S,5S,6R)-5-[(4-chlorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-1,3-benzodioxole-5-carboxamide (CHEBI:101737) is a C-glycosyl compound (CHEBI:20857)
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