Glycoside
GD036366
Name:
NoneFormula:
C11H17O8N7S2Smiles:
NS(=O)(=O)c1nnc(NCc2cn(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)s1Aglycone:
NS(=O)(=O)c1nnc(NCc2cn(O)nn2)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.64 |
| AlogP: | -4.38 | Num_rotatable_bonds: | 7 |
| MolWt: | 439.43 | Num_heavy_atoms: | 28 |
| TPSA: | 228.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD22944
Formula: C5H7O3N7S2
Smiles:
NS(=O)(=O)c1nnc(NCc2cn(O)nn2)s1| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.2 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 4 |
| MolWt: | 277.29 | Num_heavy_atoms: | 17 |
| TPSA: | 148.91 | NumAromaticRings: | 2 |
