Glycoside
GD014298
Name:
NoneFormula:
C14H18O7N4SSmiles:
NS(=O)(=O)c1ccc(-c2n[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)n2)cc1Aglycone:
NS(=O)(=O)c1ccc(-c2nc[nH]n2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.43 |
| AlogP: | -2.37 | Num_rotatable_bonds: | 4 |
| MolWt: | 386.39 | Num_heavy_atoms: | 26 |
| TPSA: | 191.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD10533
Formula: C8H8O2N4S
Smiles:
NS(=O)(=O)c1ccc(-c2nc[nH]n2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 224.25 | Num_heavy_atoms: | 15 |
| TPSA: | 101.73 | NumAromaticRings: | 2 |
