Glycoside
GD083851
Name:
NoneFormula:
C17H21O6N2F3Smiles:
O=C(N1CCc2ccc(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc2C1)C(F)(F)FAglycone:
Nc1ccc2c(c1)CN(C(=O)C(F)(F)F)CC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 406.36 | Num_heavy_atoms: | 28 |
| TPSA: | 122.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD37377
Formula: C11H11ON2F3
Smiles:
Nc1ccc2c(c1)CN(C(=O)C(F)(F)F)CC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 0 |
| MolWt: | 244.22 | Num_heavy_atoms: | 17 |
| TPSA: | 46.33 | NumAromaticRings: | 1 |
