Glycoside
GD002744
Name:
NoneFormula:
C30H32O12Smiles:
CC(=O)Oc1cc(C)cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OC(C)=O)[C@H]2OC(C)=O)c1C(=O)CCc1ccc2occc2c1Aglycone:
CC(=O)Oc1cc(C)cc(O)c1C(=O)CCc1ccc2occc2c1Sugarmoiety:
CC(=O)OC1C(O)OC(CO)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 2.8 | Num_rotatable_bonds: | 10 |
| MolWt: | 584.57 | Num_heavy_atoms: | 42 |
| TPSA: | 168.03 | NumAromaticRings: | 3 |
Unique Aglycone
AD02583
Formula: C20H18O5
Smiles:
CC(=O)Oc1cc(C)cc(O)c1C(=O)CCc1ccc2occc2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 4.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 338.36 | Num_heavy_atoms: | 25 |
| TPSA: | 76.74 | NumAromaticRings: | 3 |
