Glycoside
GD058476
Name:
NoneFormula:
C13H16O6N3FSmiles:
COc1nc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(F)cc1C#NAglycone:
COc1nc(N)c(F)cc1C#NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.28 | Num_heavy_atoms: | 23 |
| TPSA: | 148.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD29229
Formula: C7H6ON3F
Smiles:
COc1nc(N)c(F)cc1C#N| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 1 |
| MolWt: | 167.14 | Num_heavy_atoms: | 12 |
| TPSA: | 71.93 | NumAromaticRings: | 1 |
