Glycoside
GD025029
Name:
NoneFormula:
C11H15O7N5SSmiles:
CS(=O)(=O)c1nc2c(O)nc(N)nc2n1C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CS(=O)(=O)C1=Nc2c(O)nc(N)nc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -2.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 361.34 | Num_heavy_atoms: | 24 |
| TPSA: | 193.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD16643
Formula: C6H6O3N5S
Smiles:
CS(=O)(=O)C1=Nc2c(O)nc(N)nc2[N]1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 0 |
| MolWt: | 228.21 | Num_heavy_atoms: | 15 |
| TPSA: | 132.63 | NumAromaticRings: | 1 |
