Glycoside
GD052130
Name:
NoneFormula:
C13H18O7N2Smiles:
Cc1cccc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1[N+](=O)[O-]Aglycone:
Cc1cccc(N)c1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 314.29 | Num_heavy_atoms: | 22 |
| TPSA: | 145.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD27091
Formula: C7H8O2N2
Smiles:
Cc1cccc(N)c1[N+](=O)[O-]| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 152.15 | Num_heavy_atoms: | 11 |
| TPSA: | 69.16 | NumAromaticRings: | 1 |
