Glycoside
GD004713
Name:
NoneFormula:
C29H30O6NClSmiles:
CN(Cc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1)C(=O)c1ccccc1Aglycone:
CN(Cc1ccc(Cc2ccccc2Cl)cc1)C(=O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 2.72 | Num_rotatable_bonds: | 7 |
| MolWt: | 512.0 | Num_heavy_atoms: | 36 |
| TPSA: | 110.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD04077
Formula: C23H20ONCl
Smiles:
CN(Cc1ccc(Cc2ccccc2Cl)cc1)C(=O)c1ccccc1| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 5.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 349.86 | Num_heavy_atoms: | 25 |
| TPSA: | 20.31 | NumAromaticRings: | 3 |
