Glycoside
GD077183
Name:
NoneFormula:
C16H20O9N2Smiles:
CC(=O)N[C@H]1[C@H](OC(C)=O)[C@@H](O)[C@H](CO)O[C@@H]1Oc1ccc([N+](=O)[O-])cc1Aglycone:
O=[N+]([O-])c1ccc(O)cc1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 384.34 | Num_heavy_atoms: | 27 |
| TPSA: | 157.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD00091
Formula: C6H5O3N
Smiles:
O=[N+]([O-])c1ccc(O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.11 | Num_heavy_atoms: | 10 |
| TPSA: | 63.37 | NumAromaticRings: | 1 |
