Glycoside
GD069105
Name:
NoneFormula:
C17H25O4N5Smiles:
C[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CC[C@H]1CAglycone:
CC1CCN(c2ncnc3c2N=C[N]3)CC1CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 363.42 | Num_heavy_atoms: | 26 |
| TPSA: | 116.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD32763
Formula: C12H16N5
Smiles:
CC1CCN(c2ncnc3c2N=C[N]3)CC1C| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.58 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 230.29 | Num_heavy_atoms: | 17 |
| TPSA: | 55.48 | NumAromaticRings: | 1 |
