Glycoside
GD079404
Name:
NoneFormula:
C13H17O6N6ClSSmiles:
CN(C)S(=O)(=O)Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CN(C)S(=O)(=O)Nc1nc(Cl)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 408.82 | Num_heavy_atoms: | 26 |
| TPSA: | 162.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD36314
Formula: C8H8O2N6ClS
Smiles:
CN(C)S(=O)(=O)Nc1nc(Cl)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 275.7 | Num_heavy_atoms: | 17 |
| TPSA: | 101.65 | NumAromaticRings: | 1 |
