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CHEBI:110474 - 2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide

ChEBI IDCHEBI:110474
ChEBI Name2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
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DownloadsMolfile
FormulaC22H25FN2O6S
Net Charge0
Average Mass464.515
Monoisotopic Mass464.14174
SMILESCS(=O)(=O)Nc1ccc2c(c1)[C@H]1C[C@H](CC(=O)NCc3ccccc3F)O[C@H](CO)[C@H]1O2
InChIInChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20-,22+/m1/s1
InChIKeyYAXGDUBZOVIXTE-HHRWBCNNSA-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-[(2-fluorophenyl)methyl]acetamide (CHEBI:110474) is a sulfonamide (CHEBI:35358)
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