Glycoside
GD054164
Name:
NoneFormula:
C16H22O6N2Smiles:
CN1CCc2c(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cccc21Aglycone:
CN1CCc2c(C(N)=O)cccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 3 |
| MolWt: | 338.36 | Num_heavy_atoms: | 24 |
| TPSA: | 122.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD27608
Formula: C10H12ON2
Smiles:
CN1CCc2c(C(N)=O)cccc21| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 176.22 | Num_heavy_atoms: | 13 |
| TPSA: | 46.33 | NumAromaticRings: | 1 |
