Glycoside
GD006395
Name:
NoneFormula:
C18H18O5N9ClSmiles:
Nc1nc(N=NNC(=O)Nc2ccc(Cl)cc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(N=NNC(=O)Nc2ccc(Cl)cc2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.29 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 5 |
| MolWt: | 463.84 | Num_heavy_atoms: | 32 |
| TPSA: | 205.39 | NumAromaticRings: | 3 |
Unique Aglycone
AD05300
Formula: C13H9ON9Cl
Smiles:
Nc1nc(N=NNC(=O)Nc2ccc(Cl)cc2)nc2c1N=C[N]2| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.72 | Num_heavy_atoms: | 23 |
| TPSA: | 144.11 | NumAromaticRings: | 2 |
