Glycoside
GD096274
Name:
NoneFormula:
C16H16O8NCl3SSmiles:
O=S(=O)(Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)C(Cl)(Cl)ClAglycone:
O=S(=O)(Nc1ccc(O)cc1)C(Cl)(Cl)ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 452.7 | Num_heavy_atoms: | 26 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD40944
Formula: C10H6O3NCl3S
Smiles:
O=S(=O)(Nc1ccc(O)cc1)C(Cl)(Cl)Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 290.56 | Num_heavy_atoms: | 15 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
