AC1L4KJQ
2-methylsulfonyl-N-phenyl-N-[1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]acetamide
Also Known As: Acetamide, N-(2-beta-D-glucopyranosyloxy)-1-methylethyl)-2-(methylsulfonyl)-N-phenyl-|N-[1-(Hexopyranosyloxy)propan-2-yl]-2-(methanesulfonyl)-N-phenylacetamide|N-[1-(beta-D-Glucopyranosyloxy)propan-2-yl]-2-(methanesulfonyl)-N-phenylacetamide|2-methylsulfonyl-N-phenyl-N-[1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]acetamide
| Molecular Formula | C18H27NO9S |
|---|---|
| Molecular Weight | 433.14066 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 433.14066 |
| Monoisotopic Mass | 433.14066 |
| Heavy Atoms | 29 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 80994-63-4 |
|---|---|
| SMILES | CC(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)N(C2=CC=CC=C2)C(=O)CS(=O)(=O)C |
| InChIKey | FGMRYRYHQUTGCW-XYCVYUATSA-N |
Product Overview
AC1L4KJQ (CAS 80994-63-4), with molecular formula C18H27NO9S and molecular weight 433.14066 g/mol. IUPAC: 2-methylsulfonyl-N-phenyl-N-[1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]acetamide.
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