Glycoside
GD084287
Name:
NoneFormula:
C19H19O7NCl2Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)[C@H]1C[C@@H]1C(=O)c1ccc(Cl)c(Cl)c1Aglycone:
NC(=O)C1CC1C(=O)c1ccc(Cl)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 5 |
| MolWt: | 420.25 | Num_heavy_atoms: | 27 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD37623
Formula: C13H9O2NCl2
Smiles:
NC(=O)C1CC1C(=O)c1ccc(Cl)c(Cl)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.1 | Num_heavy_atoms: | 16 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
