Glycoside
GD025217
Name:
NoneFormula:
C30H29O9N7Smiles:
O=C(Cc1ccc(Nc2ncnc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)cc1)Nc1ccc(CC(=O)ON2C(=O)CCC2=O)cc1Aglycone:
O=C(Cc1ccc(Nc2ncnc3c2N=C[N]3)cc1)Nc1ccc(CC(=O)ON2C(=O)CCC2=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 10 |
| MolWt: | 631.6 | Num_heavy_atoms: | 46 |
| TPSA: | 218.33 | NumAromaticRings: | 4 |
Unique Aglycone
AD16748
Formula: C25H20O5N7
Smiles:
O=C(Cc1ccc(Nc2ncnc3c2N=C[N]3)cc1)Nc1ccc(CC(=O)ON2C(=O)CCC2=O)cc1| HBA: | 12 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.16 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 8 |
| MolWt: | 498.48 | Num_heavy_atoms: | 37 |
| TPSA: | 157.05 | NumAromaticRings: | 3 |
