Glycoside
GD025057
Name:
NoneFormula:
C13H16O4N8Smiles:
C[C@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1cnc2c(N)nc(-n3ccnn3)nc21Aglycone:
Nc1nc(-n2ccnn2)nc2c1N=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.32 | Num_heavy_atoms: | 25 |
| TPSA: | 170.25 | NumAromaticRings: | 3 |
Unique Aglycone
AD16661
Formula: C7H5N8
Smiles:
Nc1nc(-n2ccnn2)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 1 |
| MolWt: | 201.17 | Num_heavy_atoms: | 15 |
| TPSA: | 108.97 | NumAromaticRings: | 2 |
