Glycoside
GD066361
Name:
NoneFormula:
C14H17O6N2F3Smiles:
O=C(NCCc1ccc(C(F)(F)F)nc1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
NCCc1ccc(C(F)(F)F)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 8 |
| MolWt: | 366.29 | Num_heavy_atoms: | 25 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD31799
Formula: C8H9N2F3
Smiles:
NCCc1ccc(C(F)(F)F)nc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 2 |
| MolWt: | 190.17 | Num_heavy_atoms: | 13 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
