Glycoside
GD021784
Name:
NoneFormula:
C31H36O14Smiles:
O=C(C=Cc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)CC(=O)C=Cc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
O=C(C=Cc1ccc(O)cc1)CC(=O)C=Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.42 |
| AlogP: | -1.7 | Num_rotatable_bonds: | 12 |
| MolWt: | 632.62 | Num_heavy_atoms: | 45 |
| TPSA: | 232.9 | NumAromaticRings: | 2 |
Unique Aglycone
AD14836
Formula: C19H16O4
Smiles:
O=C(C=Cc1ccc(O)cc1)CC(=O)C=Cc1ccc(O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 3.35 | Num_rotatable_bonds: | 6 |
| MolWt: | 308.33 | Num_heavy_atoms: | 23 |
| TPSA: | 74.6 | NumAromaticRings: | 2 |
