Glycoside
GD027411
Name:
NoneFormula:
C31H34O7NF3Smiles:
COc1ccc(C(=O)NCCc2ccc(O[C@@H]3OC(C)(C)[C@H](OC)[C@H](O)[C@H]3O)cc2-c2cccc(C(F)(F)F)c2)cc1Aglycone:
COc1ccc(C(=O)NCCc2ccc(O)cc2-c2cccc(C(F)(F)F)c2)cc1Sugarmoiety:
COC1C(O)C(O)C(O)OC1(C)COther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.39 |
| AlogP: | 4.6 | Num_rotatable_bonds: | 9 |
| MolWt: | 589.61 | Num_heavy_atoms: | 42 |
| TPSA: | 106.48 | NumAromaticRings: | 3 |
Unique Aglycone
AD18017
Formula: C23H20O3NF3
Smiles:
COc1ccc(C(=O)NCCc2ccc(O)cc2-c2cccc(C(F)(F)F)c2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 5.06 | Num_rotatable_bonds: | 6 |
| MolWt: | 415.41 | Num_heavy_atoms: | 30 |
| TPSA: | 58.56 | NumAromaticRings: | 3 |
