Glycoside
GD008234
Name:
NoneFormula:
C24H25O6N4ClSmiles:
O=C(NN[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1cc(-c2ccc(Cl)cc2)nn1Cc1ccccc1Aglycone:
NNC(=O)c1cc(-c2ccc(Cl)cc2)nn1Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.3 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 7 |
| MolWt: | 488.93 | Num_heavy_atoms: | 34 |
| TPSA: | 149.1 | NumAromaticRings: | 3 |
Unique Aglycone
AD06602
Formula: C18H15ON4Cl
Smiles:
NNC(=O)c1cc(-c2ccc(Cl)cc2)nn1Cc1ccccc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 326.79 | Num_heavy_atoms: | 23 |
| TPSA: | 72.94 | NumAromaticRings: | 3 |
