Glycoside
GD003609
Name:
NoneFormula:
C16H20O9N4SSmiles:
NS(=O)(=O)c1ccc(C(=O)OCc2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)cc1Aglycone:
NS(=O)(=O)c1ccc(C(=O)OCC2=C[N]N=N2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -2.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.42 | Num_heavy_atoms: | 30 |
| TPSA: | 207.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD00701
Formula: C10H9O4N4S
Smiles:
NS(=O)(=O)c1ccc(C(=O)OCC2=C[N]N=N2)cc1| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 281.27 | Num_heavy_atoms: | 19 |
| TPSA: | 125.28 | NumAromaticRings: | 1 |
