Glycoside
GD003239
Name:
NoneFormula:
C18H19O4N9Smiles:
CNc1nc(-n2cc(-c3ccccn3)nn2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CNc1nc(-n2cc(-c3ccccn3)nn2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.41 | Num_heavy_atoms: | 31 |
| TPSA: | 169.15 | NumAromaticRings: | 4 |
Unique Aglycone
AD02954
Formula: C13H10N9
Smiles:
CNc1nc(-n2cc(-c3ccccn3)nn2)nc2c1N=C[N]2| HBA: | 9 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.29 | Num_heavy_atoms: | 22 |
| TPSA: | 107.87 | NumAromaticRings: | 3 |
