Glycoside
GD025289
Name:
NoneFormula:
C22H20O8NF3Smiles:
O=C(O)c1cc2c(C(F)(F)F)cc(-c3ccccc3)cc2n1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=C(O)c1cc2c(C(F)(F)F)cc(-c3ccccc3)cc2n1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 483.4 | Num_heavy_atoms: | 34 |
| TPSA: | 141.61 | NumAromaticRings: | 3 |
Unique Aglycone
AD16786
Formula: C16H10O3NF3
Smiles:
O=C(O)c1cc2c(C(F)(F)F)cc(-c3ccccc3)cc2n1O| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 4.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 321.25 | Num_heavy_atoms: | 23 |
| TPSA: | 62.46 | NumAromaticRings: | 3 |
