Glycoside
GD055894
Name:
NoneFormula:
C12H20O6NF3Smiles:
CC(C)(CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC(F)(F)FAglycone:
CC(C)(CN)CC(F)(F)FSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.83 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 8 |
| MolWt: | 331.29 | Num_heavy_atoms: | 22 |
| TPSA: | 127.09 | NumAromaticRings: | 0 |
Unique Aglycone
AD28156
Formula: C6H12NF3
Smiles:
CC(C)(CN)CC(F)(F)F| HBA: | 1 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 2 |
| MolWt: | 155.16 | Num_heavy_atoms: | 10 |
| TPSA: | 26.02 | NumAromaticRings: | 0 |
