Glycoside
GD070535
Name:
NoneFormula:
C15H17O9NSmiles:
CC(=O)O[C@@H]1[C@@H](Oc2ccccc2[N+](=O)[O-])OC[C@H](O)[C@H]1OC(C)=OAglycone:
O=[N+]([O-])c1ccccc1OSugarmoiety:
CC(=O)OC1C(O)COC(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.47 |
| AlogP: | 0.55 | Num_rotatable_bonds: | 5 |
| MolWt: | 355.3 | Num_heavy_atoms: | 25 |
| TPSA: | 134.43 | NumAromaticRings: | 1 |
Unique Aglycone
AD01290
Formula: C6H5O3N
Smiles:
O=[N+]([O-])c1ccccc1O| 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 |
