Glycoside
GD082313
Name:
NoneFormula:
C16H17O7N2ClSSmiles:
O=S(=O)(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cccc2c(Cl)nccc12Aglycone:
NS(=O)(=O)c1cccc2c(Cl)nccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.83 | Num_heavy_atoms: | 26 |
| TPSA: | 149.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD36973
Formula: C10H7O2N2ClS
Smiles:
NS(=O)(=O)c1cccc2c(Cl)nccc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.69 | Num_heavy_atoms: | 15 |
| TPSA: | 73.05 | NumAromaticRings: | 2 |
