Glycoside
GD096193
Name:
NoneFormula:
C12H15O6N4SISmiles:
CS(=O)(=O)Nc1ncnc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CS(=O)(=O)Nc1ncnc2c1C(I)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 4 |
| MolWt: | 470.25 | Num_heavy_atoms: | 24 |
| TPSA: | 146.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD40916
Formula: C7H6O2N4SI
Smiles:
CS(=O)(=O)Nc1ncnc2c1C(I)=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 337.12 | Num_heavy_atoms: | 15 |
| TPSA: | 86.05 | NumAromaticRings: | 1 |
