Glycoside
GD096298
Name:
NoneFormula:
C19H22O7N4SSmiles:
COc1cccc(CS(=O)(=O)Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
COc1cccc(CS(=O)(=O)Nc2ncnc3c2C=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 450.47 | Num_heavy_atoms: | 31 |
| TPSA: | 156.03 | NumAromaticRings: | 3 |
Unique Aglycone
AD40952
Formula: C14H13O3N4S
Smiles:
COc1cccc(CS(=O)(=O)Nc2ncnc3c2C=C[N]3)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 317.35 | Num_heavy_atoms: | 22 |
| TPSA: | 95.28 | NumAromaticRings: | 2 |
