Glycoside
GD058605
Name:
NoneFormula:
C14H17O5N4ClSmiles:
CCc1nc(C#N)c(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc1ClAglycone:
CCc1nc(C#N)c(N)nc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 4 |
| MolWt: | 344.75 | Num_heavy_atoms: | 23 |
| TPSA: | 151.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD29274
Formula: C8H7N4Cl
Smiles:
CCc1nc(C#N)c(N)nc1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 182.61 | Num_heavy_atoms: | 12 |
| TPSA: | 75.59 | NumAromaticRings: | 1 |
