Glycoside
GD090076
Name:
NoneFormula:
C18H22O9N2SSmiles:
COc1ncccc1S(=O)(=O)Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1Aglycone:
COc1ncccc1S(=O)(=O)Nc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 442.45 | Num_heavy_atoms: | 30 |
| TPSA: | 167.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD39182
Formula: C12H12O4N2S
Smiles:
COc1ncccc1S(=O)(=O)Nc1ccc(O)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 280.31 | Num_heavy_atoms: | 19 |
| TPSA: | 88.52 | NumAromaticRings: | 2 |
