Glycoside
GD119111
Name:
NoneFormula:
C21H30O14Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(OC(=O)C(O)CC(=O)O)C2CAglycone:
COC(=O)C1=COC(O)C2C1CC(OC(=O)C(O)CC(=O)O)C2CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.76 |
| AlogP: | -2.76 | Num_rotatable_bonds: | 8 |
| MolWt: | 506.46 | Num_heavy_atoms: | 35 |
| TPSA: | 218.74 | NumAromaticRings: | 0 |
Unique Aglycone
AD47680
Formula: C15H20O9
Smiles:
COC(=O)C1=COC(O)C2C1CC(OC(=O)C(O)CC(=O)O)C2C| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 5 |
| MolWt: | 344.32 | Num_heavy_atoms: | 24 |
| TPSA: | 139.59 | NumAromaticRings: | 0 |
