Glycoside
GD090399
Name:
NoneFormula:
C13H13O7NF3BrSmiles:
O=C(Nc1ccc(Br)cc1OC(F)(F)F)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1ccc(Br)cc1OC(F)(F)FSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 432.15 | Num_heavy_atoms: | 25 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD39337
Formula: C7H5ONF3Br
Smiles:
Nc1ccc(Br)cc1OC(F)(F)F| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.93 | Num_rotatable_bonds: | 1 |
| MolWt: | 256.02 | Num_heavy_atoms: | 13 |
| TPSA: | 35.25 | NumAromaticRings: | 1 |
