Glycoside
GD016529
Name:
NoneFormula:
C20H21O5N7Smiles:
COc1ccc(-c2cnn(-c3nc(N)c4ncn([C@@H]5O[C@H](CO)[C@H](O)[C@H]5O)c4n3)c2)cc1Aglycone:
COc1ccc(-c2cnn(-c3nc(N)c4c(n3)[N]C=N4)c2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 439.43 | Num_heavy_atoms: | 32 |
| TPSA: | 166.59 | NumAromaticRings: | 4 |
Unique Aglycone
AD11887
Formula: C15H12ON7
Smiles:
COc1ccc(-c2cnn(-c3nc(N)c4c(n3)[N]C=N4)c2)cc1| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 306.31 | Num_heavy_atoms: | 23 |
| TPSA: | 105.31 | NumAromaticRings: | 3 |
