Glycoside
GD088519
Name:
NoneFormula:
C15H16O8N2Cl2SSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(S(=O)(=O)N(Cl)Cl)cc1Aglycone:
NC(=O)c1ccc(S(=O)(=O)N(Cl)Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.49 | Num_rotatable_bonds: | 5 |
| MolWt: | 431.25 | Num_heavy_atoms: | 26 |
| TPSA: | 156.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD38723
Formula: C9H6O3N2Cl2S
Smiles:
NC(=O)c1ccc(S(=O)(=O)N(Cl)Cl)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 269.11 | Num_heavy_atoms: | 15 |
| TPSA: | 80.47 | NumAromaticRings: | 1 |
