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CHEBI:110490 - 2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2,5-difluorophenyl)methyl]acetamide

ChEBI IDCHEBI:110490
ChEBI Name2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2,5-difluorophenyl)methyl]acetamide
Stars
DownloadsMolfile
FormulaC27H25F3N2O6S
Net Charge0
Average Mass562.566
Monoisotopic Mass562.13854
SMILESO=C(C[C@H]1C[C@H]2c3cc(NS(=O)(=O)c4ccc(F)cc4)ccc3O[C@H]2[C@H](CO)O1)NCc1cc(F)ccc1F
InChIInChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25+,27-/m1/s1
InChIKeyFUBUSFISZJCQOM-KRPQKCCHSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2,5-difluorophenyl)methyl]acetamide (CHEBI:110490) is a sulfonamide (CHEBI:35358)
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