Glycoside
GD014153
Name:
NoneFormula:
C25H30O12Smiles:
COC(=O)C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]2CO[C@H](OC(=O)C=Cc3ccccc3)C[C@H]12Aglycone:
COC(=O)C1=COC(O)C2COC(OC(=O)C=Cc3ccccc3)CC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 7 |
| MolWt: | 522.5 | Num_heavy_atoms: | 37 |
| TPSA: | 170.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD10452
Formula: C19H20O7
Smiles:
COC(=O)C1=COC(O)C2COC(OC(=O)C=Cc3ccccc3)CC12| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.37 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 360.36 | Num_heavy_atoms: | 26 |
| TPSA: | 91.29 | NumAromaticRings: | 1 |
