Glycoside
GD006572
Name:
NoneFormula:
C19H18O5N2Cl2Smiles:
OC[C@@H]1O[C@H](c2ccc(Cl)c(Cc3ccc(Cl)nn3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccc(Cc2ccccc2Cl)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 4 |
| MolWt: | 401.25 | Num_heavy_atoms: | 26 |
| TPSA: | 115.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD05430
Formula: C13H8N2Cl2
Smiles:
Clc1ccc(Cc2ccccc2Cl)nn1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.09 |
| AlogP: | 3.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 239.11 | Num_heavy_atoms: | 15 |
| TPSA: | 25.78 | NumAromaticRings: | 2 |
