Glycoside
GD052093
Name:
NoneFormula:
C13H18O7N2Smiles:
CCOc1ccc(N[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c([N+](=O)[O-])c1Aglycone:
CCOc1ccc(N)c([N+](=O)[O-])c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 5 |
| MolWt: | 314.29 | Num_heavy_atoms: | 22 |
| TPSA: | 134.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD06866
Formula: C8H10O3N2
Smiles:
CCOc1ccc(N)c([N+](=O)[O-])c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 182.18 | Num_heavy_atoms: | 13 |
| TPSA: | 78.39 | NumAromaticRings: | 1 |
