Glycoside
GD091155
Name:
NoneFormula:
C19H23O9NSSmiles:
COc1ccccc1Oc1ccc(S(=O)(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1Aglycone:
COc1ccccc1Oc1ccc(S(N)(=O)=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 7 |
| MolWt: | 441.46 | Num_heavy_atoms: | 30 |
| TPSA: | 154.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD39736
Formula: C13H13O4NS
Smiles:
COc1ccccc1Oc1ccc(S(N)(=O)=O)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 279.32 | Num_heavy_atoms: | 19 |
| TPSA: | 78.62 | NumAromaticRings: | 2 |
