Glycoside
GD125711
Name:
NoneFormula:
C13H20O7N2Smiles:
CCOc1ccc(NC2OCC(O)C(O)C2O)c([NH+]([O-])O)c1Aglycone:
CCOc1ccc(N)c([NH+]([O-])O)c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 316.31 | Num_heavy_atoms: | 22 |
| TPSA: | 138.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD50850
Formula: C8H12O3N2
Smiles:
CCOc1ccc(N)c([NH+]([O-])O)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 184.19 | Num_heavy_atoms: | 13 |
| TPSA: | 82.98 | NumAromaticRings: | 1 |
