Glycoside
GD009639
Name:
NoneFormula:
C14H18O7N4SSmiles:
NS(=O)(=O)c1cccc(-c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)c1Aglycone:
NS(=O)(=O)c1cccc(C2=C[N]N=N2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | -2.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 386.39 | Num_heavy_atoms: | 26 |
| TPSA: | 181.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD05971
Formula: C8H7O2N4S
Smiles:
NS(=O)(=O)c1cccc(C2=C[N]N=N2)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 223.24 | Num_heavy_atoms: | 15 |
| TPSA: | 98.98 | NumAromaticRings: | 1 |
