Glycoside
GD058630
Name:
NoneFormula:
C14H17O6N2FSmiles:
COc1c(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc(F)c1C#NAglycone:
COc1c(N)ccc(F)c1C#NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.3 | Num_heavy_atoms: | 23 |
| TPSA: | 135.2 | NumAromaticRings: | 1 |
Unique Aglycone
AD29286
Formula: C8H7ON2F
Smiles:
COc1c(N)ccc(F)c1C#N| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 1 |
| MolWt: | 166.15 | Num_heavy_atoms: | 12 |
| TPSA: | 59.04 | NumAromaticRings: | 1 |
