Glycoside
GD067071
Name:
NoneFormula:
C14H18O9N2Smiles:
COC(=O)c1cc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc([N+](=O)[O-])c1Aglycone:
COC(=O)c1cc(N)cc([N+](=O)[O-])c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 358.3 | Num_heavy_atoms: | 25 |
| TPSA: | 171.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD32054
Formula: C8H8O4N2
Smiles:
COC(=O)c1cc(N)cc([N+](=O)[O-])c1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 196.16 | Num_heavy_atoms: | 14 |
| TPSA: | 95.46 | NumAromaticRings: | 1 |
