Glycoside
GD088872
Name:
NoneFormula:
C17H22O11N2Smiles:
COC(=O)C(C(=O)OC)c1cc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1[N+](=O)[O-]Aglycone:
COC(=O)C(C(=O)OC)c1cc(N)ccc1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 7 |
| MolWt: | 430.37 | Num_heavy_atoms: | 30 |
| TPSA: | 197.92 | NumAromaticRings: | 1 |
Unique Aglycone
AD38869
Formula: C11H12O6N2
Smiles:
COC(=O)C(C(=O)OC)c1cc(N)ccc1[N+](=O)[O-]| HBA: | 8 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 268.23 | Num_heavy_atoms: | 19 |
| TPSA: | 121.76 | NumAromaticRings: | 1 |
