Glycoside
GD038069
Name:
(6r)-5-o-acetyl-2,6-anhydro-6-{[4-(sulfamoyloxy)piperidin-1-yl]sulfonyl}-l-glucitolFormula:
C13H24O11N2S2Smiles:
CC(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1S(=O)(=O)N1CCC(OS(N)(=O)=O)CC1Aglycone:
NS(=O)(=O)OC1CCN([S](=O)=O)CC1Sugarmoiety:
CC(=O)OC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | -3.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 448.47 | Num_heavy_atoms: | 28 |
| TPSA: | 202.99 | NumAromaticRings: | 0 |
Unique Aglycone
AD10434
Formula: C5H11O5N2S2
Smiles:
NS(=O)(=O)OC1CCN([S](=O)=O)CC1| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 243.29 | Num_heavy_atoms: | 14 |
| TPSA: | 106.77 | NumAromaticRings: | 0 |
