Glycoside
GD025313
Name:
NoneFormula:
C15H18O9Smiles:
CC(=O)Oc1ccccc1C(=O)O[C@@H]1[C@H](O)[C@H](O)O[C@H](CO)[C@H]1OAglycone:
CC(=O)Oc1ccccc1C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 342.3 | Num_heavy_atoms: | 24 |
| TPSA: | 142.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD16801
Formula: C9H8O4
Smiles:
CC(=O)Oc1ccccc1C(=O)O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 2 |
| MolWt: | 180.16 | Num_heavy_atoms: | 13 |
| TPSA: | 63.6 | NumAromaticRings: | 1 |
