Glycoside
GD058592
Name:
NoneFormula:
C12H14O7N4Smiles:
N#Cc1nc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1[N+](=O)[O-]Aglycone:
N#Cc1nc(N)ccc1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.93 | Num_rotatable_bonds: | 4 |
| MolWt: | 326.27 | Num_heavy_atoms: | 23 |
| TPSA: | 182.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD29268
Formula: C6H4O2N4
Smiles:
N#Cc1nc(N)ccc1[N+](=O)[O-]| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.12 | Num_heavy_atoms: | 12 |
| TPSA: | 105.84 | NumAromaticRings: | 1 |
