Glycoside
GD083053
Name:
NoneFormula:
C17H21O7N3SSmiles:
O=S(=O)(Nc1ccccn1)c1ccc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.91 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.44 | Num_heavy_atoms: | 28 |
| TPSA: | 161.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD37145
Formula: C11H11O2N3S
Smiles:
Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 249.3 | Num_heavy_atoms: | 17 |
| TPSA: | 85.08 | NumAromaticRings: | 2 |
