Glycoside
GD026838
Name:
NoneFormula:
C21H22O6NF3Smiles:
CC(=O)N[C@@H]1[C@H](Oc2ccccc2-c2cccc(C(F)(F)F)c2)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Oc1ccccc1-c1cccc(C(F)(F)F)c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 441.4 | Num_heavy_atoms: | 31 |
| TPSA: | 108.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD17671
Formula: C13H9OF3
Smiles:
Oc1ccccc1-c1cccc(C(F)(F)F)c1| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 4.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 238.21 | Num_heavy_atoms: | 17 |
| TPSA: | 20.23 | NumAromaticRings: | 2 |
