Glycoside
GD101101
Name:
NoneFormula:
C20H23O7NS2Smiles:
C[S@](=O)c1ccccc1C(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1Aglycone:
CS(=O)c1ccccc1C(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 453.54 | Num_heavy_atoms: | 30 |
| TPSA: | 136.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD42730
Formula: C14H13O2NS2
Smiles:
CS(=O)c1ccccc1C(=O)Nc1ccc(S)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.97 | Num_rotatable_bonds: | 3 |
| MolWt: | 291.4 | Num_heavy_atoms: | 19 |
| TPSA: | 46.17 | NumAromaticRings: | 2 |
