Glycoside
GD074119
Name:
NoneFormula:
C15H19O7N3SSmiles:
O=S(=O)(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(-n2cccn2)cc1Aglycone:
NS(=O)(=O)c1ccc(-n2cccn2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -2.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 385.4 | Num_heavy_atoms: | 26 |
| TPSA: | 154.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD34255
Formula: C9H9O2N3S
Smiles:
NS(=O)(=O)c1ccc(-n2cccn2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 223.26 | Num_heavy_atoms: | 15 |
| TPSA: | 77.98 | NumAromaticRings: | 2 |
