Glycoside
GD097083
Name:
NoneFormula:
C21H23O7N5SSmiles:
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ncnc4c3ccn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc21Aglycone:
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ncnc4c3C=C[N]4)ccc21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 489.51 | Num_heavy_atoms: | 34 |
| TPSA: | 167.11 | NumAromaticRings: | 3 |
Unique Aglycone
AD41266
Formula: C16H14O3N5S
Smiles:
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ncnc4c3C=C[N]4)ccc21| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 356.39 | Num_heavy_atoms: | 25 |
| TPSA: | 106.36 | NumAromaticRings: | 2 |
