Glycoside
GD100862
Name:
NoneFormula:
C17H19O7N2ClS3Smiles:
Cc1nc(Cl)sc1S(=O)(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1nc(Cl)sc1S(=O)(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 6 |
| MolWt: | 482.99 | Num_heavy_atoms: | 29 |
| TPSA: | 149.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD42615
Formula: C11H9O2N2ClS3
Smiles:
Cc1nc(Cl)sc1S(=O)(=O)Nc1ccc(S)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 320.85 | Num_heavy_atoms: | 18 |
| TPSA: | 59.06 | NumAromaticRings: | 2 |
