Glycoside
GD085029
Name:
NoneFormula:
C17H24O9N2Smiles:
CC(C)(C)OC(=O)c1ccc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1[N+](=O)[O-]Aglycone:
CC(C)(C)OC(=O)c1ccc(N)cc1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 400.38 | Num_heavy_atoms: | 28 |
| TPSA: | 171.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD38065
Formula: C11H14O4N2
Smiles:
CC(C)(C)OC(=O)c1ccc(N)cc1[N+](=O)[O-]| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.24 | Num_heavy_atoms: | 17 |
| TPSA: | 95.46 | NumAromaticRings: | 1 |
