CHEBI:110436 - 2-[(1R,3S,4aS,9aR)-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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ChEBI Name 2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide ChEBI ID CHEBI:110436 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C22H25FN2O6S Net Charge 0 Average Mass 464.509 Monoisotopic Mass 464.14174 InChI InChI=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+/m0/s1 InChIKey YAXGDUBZOVIXTE-RRZHCZHMSA-N SMILES CS(=O)(=O)NC1=CC2=C(C=C1)O[C@@H]3[C@H]2C[C@H](O[C@@H]3CO)CC(=O)NCC4=CC=CC=C4F ChEBI Ontology Outgoing 2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide (CHEBI:110436) is a sulfonamide (CHEBI:35358) Manual Xref Database LSM-21883 LINCS View more database links