Glycoside
GD084246
Name:
NoneFormula:
C18H21O6N5Smiles:
COc1ccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1OAglycone:
COc1ccc(CNc2ncnc3c2N=C[N]3)cc1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 403.4 | Num_heavy_atoms: | 29 |
| TPSA: | 155.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD15163
Formula: C13H12O2N5
Smiles:
COc1ccc(CNc2ncnc3c2N=C[N]3)cc1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 270.27 | Num_heavy_atoms: | 20 |
| TPSA: | 93.73 | NumAromaticRings: | 2 |
