Glycoside
GD094818
Name:
NoneFormula:
C11H14O6N5SISmiles:
CS(=O)(=O)Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CS(=O)(=O)Nc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -1.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 471.23 | Num_heavy_atoms: | 24 |
| TPSA: | 159.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD40551
Formula: C6H5O2N5SI
Smiles:
CS(=O)(=O)Nc1nc(I)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 338.11 | Num_heavy_atoms: | 15 |
| TPSA: | 98.41 | NumAromaticRings: | 1 |
