Glycoside
GD002197
Name:
NoneFormula:
C19H24O6NClSmiles:
O=C(C[C@H](c1ccc(Cl)cc1)C1CC1)N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NC(=O)CC(c1ccc(Cl)cc1)C1CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 385.84 | Num_heavy_atoms: | 26 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD02125
Formula: C13H14ONCl
Smiles:
NC(=O)CC(c1ccc(Cl)cc1)C1CC1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 223.7 | Num_heavy_atoms: | 15 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
