Glycoside
GD050965
Name:
NoneFormula:
C12H16O6N4Smiles:
COc1nc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)ncc1C#NAglycone:
COc1nc(N)ncc1C#NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 312.28 | Num_heavy_atoms: | 22 |
| TPSA: | 160.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD26790
Formula: C6H6ON4
Smiles:
COc1nc(N)ncc1C#N| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 150.14 | Num_heavy_atoms: | 11 |
| TPSA: | 84.82 | NumAromaticRings: | 1 |
