Glycoside
GD101313
Name:
NoneFormula:
C21H24O8NClSSmiles:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 8 |
| MolWt: | 473.93 | Num_heavy_atoms: | 31 |
| TPSA: | 145.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD42869
Formula: C15H14O3NClS
Smiles:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ccc(O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 3.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 311.79 | Num_heavy_atoms: | 20 |
| TPSA: | 66.4 | NumAromaticRings: | 2 |
