Glycoside
GD036551
Name:
NoneFormula:
C22H26O10Smiles:
COc1ccc2c(c1)OC[C@H](c1ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc1O)[C@H]2OAglycone:
COc1ccc2c(c1)OCC(c1ccc(O)cc1O)C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 450.44 | Num_heavy_atoms: | 32 |
| TPSA: | 158.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD23040
Formula: C16H16O5
Smiles:
COc1ccc2c(c1)OCC(c1ccc(O)cc1O)C2O| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 2.32 | Num_rotatable_bonds: | 2 |
| MolWt: | 288.3 | Num_heavy_atoms: | 21 |
| TPSA: | 79.15 | NumAromaticRings: | 2 |
