Glycoside
GD036529
Name:
NoneFormula:
C23H28O8Smiles:
CCc1ccc(C(=O)Oc2ccc(CCO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
CCc1ccc(C(=O)Oc2ccc(CCO)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 8 |
| MolWt: | 432.47 | Num_heavy_atoms: | 31 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD23027
Formula: C17H18O3
Smiles:
CCc1ccc(C(=O)Oc2ccc(CCO)cc2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 270.33 | Num_heavy_atoms: | 20 |
| TPSA: | 46.53 | NumAromaticRings: | 2 |
