Glycoside
GD103748
Name:
NoneFormula:
C20H22O7N2S2Smiles:
Cc1ccc(S(=O)(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc2)cc1C#NAglycone:
Cc1ccc(S(=O)(=O)Nc2ccc(S)cc2)cc1C#NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 466.54 | Num_heavy_atoms: | 31 |
| TPSA: | 160.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD43866
Formula: C14H12O2N2S2
Smiles:
Cc1ccc(S(=O)(=O)Nc2ccc(S)cc2)cc1C#N| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 304.4 | Num_heavy_atoms: | 20 |
| TPSA: | 69.96 | NumAromaticRings: | 2 |
