Glycoside
GD018119
Name:
NoneFormula:
C25H25O4N7Smiles:
Nc1nc(NN=CC=C(c2ccccc2)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(NN=CC=C(c2ccccc2)c2ccccc2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.2 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 7 |
| MolWt: | 487.52 | Num_heavy_atoms: | 36 |
| TPSA: | 163.93 | NumAromaticRings: | 4 |
Unique Aglycone
AD12838
Formula: C20H16N7
Smiles:
Nc1nc(NN=CC=C(c2ccccc2)c2ccccc2)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 3.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 354.4 | Num_heavy_atoms: | 27 |
| TPSA: | 102.65 | NumAromaticRings: | 3 |
