Glycoside
GD065502
Name:
NoneFormula:
C12H16O6N3F3Smiles:
O=c1ncc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cn1CC(F)(F)FAglycone:
Nc1cnc(=O)n(CC(F)(F)F)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 4 |
| MolWt: | 355.27 | Num_heavy_atoms: | 24 |
| TPSA: | 137.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD31498
Formula: C6H6ON3F3
Smiles:
Nc1cnc(=O)n(CC(F)(F)F)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 1 |
| MolWt: | 193.13 | Num_heavy_atoms: | 13 |
| TPSA: | 60.91 | NumAromaticRings: | 1 |
