Glycoside
GD084826
Name:
NoneFormula:
C18H22O6N6Smiles:
CCOC(=O)c1cc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1CAglycone:
CCOC(=O)c1cc(Nc2ncnc3c2N=C[N]3)cn1CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 418.41 | Num_heavy_atoms: | 30 |
| TPSA: | 156.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD37946
Formula: C13H13O2N6
Smiles:
CCOC(=O)c1cc(Nc2ncnc3c2N=C[N]3)cn1C| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.23 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 285.29 | Num_heavy_atoms: | 21 |
| TPSA: | 95.5 | NumAromaticRings: | 2 |
