Glycoside
GD082381
Name:
NoneFormula:
C17H21O6N7Smiles:
COC(=O)Cn1ncc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1CAglycone:
COC(=O)Cn1ncc(Nc2ncnc3c2N=C[N]3)c1CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 419.4 | Num_heavy_atoms: | 30 |
| TPSA: | 169.67 | NumAromaticRings: | 3 |
Unique Aglycone
AD37019
Formula: C12H12O2N7
Smiles:
COC(=O)Cn1ncc(Nc2ncnc3c2N=C[N]3)c1C| HBA: | 9 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 4 |
| MolWt: | 286.28 | Num_heavy_atoms: | 21 |
| TPSA: | 108.39 | NumAromaticRings: | 2 |
