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CHEBI:110237 - 2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide

ChEBI IDCHEBI:110237
ChEBI Name2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
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DownloadsMolfile
FormulaC23H28N2O7S
Net Charge0
Average Mass476.551
Monoisotopic Mass476.16172
SMILESCOc1ccc(CNC(=O)C[C@H]2C[C@@H]3c4cc(NS(C)(=O)=O)ccc4O[C@@H]3[C@@H](CO)O2)cc1
InChIInChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21-,23+/m1/s1
InChIKeyQYXXDFPSNSEWLS-LHWDRQQYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide (CHEBI:110237) is a sulfonamide (CHEBI:35358)
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