Glycoside
GD018551
Name:
NoneFormula:
C12H15O7N3Smiles:
O=C(NNc1ccc([N+](=O)[O-])cc1)C1OC(CO)C(O)C1OAglycone:
O=CNNc1ccc([N+](=O)[O-])cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 313.27 | Num_heavy_atoms: | 22 |
| TPSA: | 154.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD13067
Formula: C7H7O3N3
Smiles:
O=CNNc1ccc([N+](=O)[O-])cc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 181.15 | Num_heavy_atoms: | 13 |
| TPSA: | 84.27 | NumAromaticRings: | 1 |
