Glycoside
GD070117
Name:
NoneFormula:
C18H19O5N2ClSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2nc(Cl)ccc2-c2ccccc2)[C@@H](O)[C@@H]1OAglycone:
Nc1nc(Cl)ccc1-c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 366.8 | Num_heavy_atoms: | 25 |
| TPSA: | 115.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD33210
Formula: C12H9N2Cl
Smiles:
Nc1nc(Cl)ccc1-c1ccccc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 204.66 | Num_heavy_atoms: | 14 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
