Glycoside
GD078977
Name:
NoneFormula:
C16H17O11NSmiles:
CC(=O)O[C@H]1[C@@H](OC(=O)O)[C@H](OC(C)=O)CO[C@@H]1Oc1ccc([N+](=O)[O-])cc1Aglycone:
O=[N+]([O-])c1ccc(O)cc1Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(=O)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 399.31 | Num_heavy_atoms: | 28 |
| TPSA: | 160.73 | 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 |
