Glycoside
GD091128
Name:
NoneFormula:
C20H28O6N2F2Smiles:
C[C@H](c1ccccc1)N1CCC(F)(F)C[C@H]1C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(c1ccccc1)N1CCC(F)(F)CC1C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 430.45 | Num_heavy_atoms: | 30 |
| TPSA: | 122.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD39723
Formula: C14H18ON2F2
Smiles:
CC(c1ccccc1)N1CCC(F)(F)CC1C(N)=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 268.31 | Num_heavy_atoms: | 19 |
| TPSA: | 46.33 | NumAromaticRings: | 1 |
