Glycoside
GD071125
Name:
FraxidinglucosideFormula:
C17H20O10Smiles:
COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1OCAglycone:
COc1cc2ccc(=O)oc2c(O)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 384.34 | Num_heavy_atoms: | 27 |
| TPSA: | 148.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD33556
Formula: C11H10O5
Smiles:
COc1cc2ccc(=O)oc2c(O)c1OC| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 222.2 | Num_heavy_atoms: | 16 |
| TPSA: | 68.9 | NumAromaticRings: | 2 |
