Glycoside
GD010558
Name:
NoneFormula:
C11H15O6N5SSmiles:
CS(=O)(=O)c1nc(N)nc2c1ncn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CS(=O)(=O)c1nc(N)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -2.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 345.34 | Num_heavy_atoms: | 23 |
| TPSA: | 173.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD08137
Formula: C6H6O2N5S
Smiles:
CS(=O)(=O)c1nc(N)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 1 |
| MolWt: | 212.21 | Num_heavy_atoms: | 14 |
| TPSA: | 112.4 | NumAromaticRings: | 1 |
