Glycoside
GD063105
Name:
NoneFormula:
C13H17O6N5SSmiles:
C=CS(=O)(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OCAglycone:
C=CS(=O)(=O)Nc1ncnc2c1N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 371.38 | Num_heavy_atoms: | 25 |
| TPSA: | 148.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD30421
Formula: C7H6O2N5S
Smiles:
C=CS(=O)(=O)Nc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 224.22 | Num_heavy_atoms: | 15 |
| TPSA: | 98.41 | NumAromaticRings: | 1 |
