Glycoside
GD022315
Name:
NoneFormula:
C20H21O8FSmiles:
COC(=O)c1cccc(-c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(F)c2)c1Aglycone:
COC(=O)c1cccc(-c2ccc(O)c(F)c2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 5 |
| MolWt: | 408.38 | Num_heavy_atoms: | 29 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD15146
Formula: C14H11O3F
Smiles:
COC(=O)c1cccc(-c2ccc(O)c(F)c2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.98 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.24 | Num_heavy_atoms: | 18 |
| TPSA: | 46.53 | NumAromaticRings: | 2 |
