Glycoside
GD092700
Name:
NoneFormula:
C21H30O9Smiles:
COc1ccc([C@H]2C[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]3CCC[C@H]3O2)cc1OAglycone:
COc1ccc(C2CC(O)C3CCCC3O2)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 426.46 | Num_heavy_atoms: | 30 |
| TPSA: | 138.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD38250
Formula: C15H20O4
Smiles:
COc1ccc(C2CC(O)C3CCCC3O2)cc1O| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 2 |
| MolWt: | 264.32 | Num_heavy_atoms: | 19 |
| TPSA: | 58.92 | NumAromaticRings: | 1 |
