Glycoside
GD000652
Name:
NoneFormula:
C20H22O9Smiles:
Cc1c(O)cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(C(=O)c2ccccc2)c1OAglycone:
Cc1c(O)cc(O)c(C(=O)c2ccccc2)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.39 | Num_heavy_atoms: | 29 |
| TPSA: | 156.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD00705
Formula: C14H12O4
Smiles:
Cc1c(O)cc(O)c(C(=O)c2ccccc2)c1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.25 | Num_heavy_atoms: | 18 |
| TPSA: | 77.76 | NumAromaticRings: | 2 |
