Glycoside
GD032932
Name:
NoneFormula:
C14H20O7N2Smiles:
O=[N+]([O-])c1cccc(CNC[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
CNCc1cccc([N+](=O)[O-])c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 6 |
| MolWt: | 328.32 | Num_heavy_atoms: | 23 |
| TPSA: | 145.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD21061
Formula: C8H10O2N2
Smiles:
CNCc1cccc([N+](=O)[O-])c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 166.18 | Num_heavy_atoms: | 12 |
| TPSA: | 55.17 | NumAromaticRings: | 1 |
