Glycoside
GD092227
Name:
NoneFormula:
C18H21O6N7Smiles:
COc1cc(C/N=N/c2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)ccc1OAglycone:
COc1cc(CN=NC2=Nc3c(N)ncnc3[N]2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 431.41 | Num_heavy_atoms: | 31 |
| TPSA: | 193.72 | NumAromaticRings: | 3 |
Unique Aglycone
AD40253
Formula: C13H12O2N7
Smiles:
COc1cc(CN=NC2=Nc3c(N)ncnc3[N]2)ccc1O| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 132.44 | NumAromaticRings: | 2 |
