Glycoside
GD083603
Name:
NoneFormula:
C18H22O6N2Cl2Smiles:
CN(C)[C@H](CNC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)c1ccc(Cl)cc1ClAglycone:
CN(C)C(CN)c1ccc(Cl)cc1ClSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 9 |
| MolWt: | 409.27 | Num_heavy_atoms: | 26 |
| TPSA: | 130.33 | NumAromaticRings: | 1 |
Unique Aglycone
AD37291
Formula: C12H14N2Cl2
Smiles:
CN(C)C(CN)c1ccc(Cl)cc1Cl| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 3 |
| MolWt: | 233.14 | Num_heavy_atoms: | 14 |
| TPSA: | 29.26 | NumAromaticRings: | 1 |
