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CHEBI:129454 - 2-[(3S,6aR,8R,10aR)-1-(2-chlorophenyl)sulfonyl-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-methylacetamide

ChEBI IDCHEBI:129454
ChEBI Name2-[(3S,6aR,8R,10aR)-1-(2-chlorophenyl)sulfonyl-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-methylacetamide
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DownloadsMolfile
FormulaC18H25ClN2O6S
Net Charge0
Average Mass432.926
Monoisotopic Mass432.11219
SMILESCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2Cl)O1
InChIInChI=1S/C18H25ClN2O6S/c1-20-18(23)8-13-6-7-15-16(27-13)11-26-10-12(22)9-21(15)28(24,25)17-5-3-2-4-14(17)19/h2-5,12-13,15-16,22H,6-11H2,1H3,(H,20,23)/t12-,13+,15+,16-/m0/s1
InChIKeyVNKPIXQPVYVBER-XNISGKROSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3S,6aR,8R,10aR)-1-(2-chlorophenyl)sulfonyl-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-methylacetamide (CHEBI:129454) is a sulfonamide (CHEBI:35358)
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