Glycoside
GD031512
Name:
NoneFormula:
C19H23O6N2F3Smiles:
CCc1ccc(Cc2c(C(F)(F)F)n[nH]c2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
CCc1ccc(Cc2c(C(F)(F)F)n[nH]c2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 6 |
| MolWt: | 432.4 | Num_heavy_atoms: | 30 |
| TPSA: | 128.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD10372
Formula: C13H13ON2F3
Smiles:
CCc1ccc(Cc2c(C(F)(F)F)n[nH]c2O)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.25 | Num_heavy_atoms: | 19 |
| TPSA: | 48.91 | NumAromaticRings: | 2 |
