Glycoside
GD059349
Name:
NoneFormula:
C13H16O6NF3Smiles:
O=C(Nc1cccc(C(F)(F)F)c1)[C@@H](O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1cccc(C(F)(F)F)c1Sugarmoiety:
O=C(O)C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 6 |
| MolWt: | 339.27 | Num_heavy_atoms: | 23 |
| TPSA: | 130.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD21356
Formula: C7H6NF3
Smiles:
Nc1cccc(C(F)(F)F)c1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 0 |
| MolWt: | 161.13 | Num_heavy_atoms: | 11 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
