Glycoside
GD055817
Name:
NoneFormula:
C13H14O6NF3Smiles:
O=C(NCc1cc(F)c(F)c(F)c1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
NCc1cc(F)c(F)c(F)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.64 | Num_rotatable_bonds: | 7 |
| MolWt: | 337.25 | Num_heavy_atoms: | 23 |
| TPSA: | 127.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD28138
Formula: C7H6NF3
Smiles:
NCc1cc(F)c(F)c(F)c1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 1 |
| MolWt: | 161.13 | Num_heavy_atoms: | 11 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
