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CHEBI:123096 - 2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide

ChEBI IDCHEBI:123096
ChEBI Name2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide
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DownloadsMolfile
FormulaC23H28N2O7S
Net Charge0
Average Mass476.551
Monoisotopic Mass476.16172
SMILESCOc1ccccc1CNC(=O)C[C@@H]1C[C@H]2c3cc(NS(C)(=O)=O)ccc3O[C@H]2[C@H](CO)O1
InChIInChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21-,23+/m0/s1
InChIKeySVPAUNQWUYQQNC-DJTDUFQSSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-methoxyphenyl)methyl]acetamide (CHEBI:123096) is a sulfonamide (CHEBI:35358)
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