Glycoside
GD055477
Name:
NoneFormula:
C14H17O6NF2Smiles:
Cc1ccc(CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(F)c1FAglycone:
Cc1ccc(CN)c(F)c1FSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 333.29 | Num_heavy_atoms: | 23 |
| TPSA: | 127.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD28051
Formula: C8H9NF2
Smiles:
Cc1ccc(CN)c(F)c1F| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 1 |
| MolWt: | 157.16 | Num_heavy_atoms: | 11 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
