Glycoside
GD090508
Name:
NoneFormula:
C21H25O6N5Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1nc(-c2cn(CC3CC3)cn2)n2ccccc12Aglycone:
NC(=O)c1nc(-c2cn(CC3CC3)cn2)n2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 443.46 | Num_heavy_atoms: | 32 |
| TPSA: | 154.37 | NumAromaticRings: | 3 |
Unique Aglycone
AD39376
Formula: C15H15ON5
Smiles:
NC(=O)c1nc(-c2cn(CC3CC3)cn2)n2ccccc12| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 281.32 | Num_heavy_atoms: | 21 |
| TPSA: | 78.21 | NumAromaticRings: | 3 |
