Glycoside
GD069928
Name:
NoneFormula:
C15H18O6N3ClSmiles:
COc1nc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(C#N)c(C)c1ClAglycone:
COc1nc(N)c(C#N)c(C)c1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 359.77 | Num_heavy_atoms: | 24 |
| TPSA: | 148.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD33125
Formula: C9H8ON3Cl
Smiles:
COc1nc(N)c(C#N)c(C)c1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 1 |
| MolWt: | 197.62 | Num_heavy_atoms: | 13 |
| TPSA: | 71.93 | NumAromaticRings: | 1 |
