Glycoside
GD089721
Name:
NoneFormula:
C17H18O8N3ClSSmiles:
O=S(=O)(Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)c1cnc(Cl)nc1Aglycone:
O=S(=O)(Nc1ccc(O)cc1)c1cnc(Cl)nc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 6 |
| MolWt: | 447.85 | Num_heavy_atoms: | 29 |
| TPSA: | 171.33 | NumAromaticRings: | 2 |
Unique Aglycone
AD39099
Formula: C11H8O3N3ClS
Smiles:
O=S(=O)(Nc1ccc(O)cc1)c1cnc(Cl)nc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 285.71 | Num_heavy_atoms: | 18 |
| TPSA: | 92.18 | NumAromaticRings: | 2 |
