Glycoside
GD058186
Name:
NoneFormula:
C12H17O8N3Smiles:
COc1ccnc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1[N+](=O)[O-]Aglycone:
COc1ccnc(N)c1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 331.28 | Num_heavy_atoms: | 23 |
| TPSA: | 167.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD29131
Formula: C6H7O3N3
Smiles:
COc1ccnc(N)c1[N+](=O)[O-]| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 2 |
| MolWt: | 169.14 | Num_heavy_atoms: | 12 |
| TPSA: | 91.28 | NumAromaticRings: | 1 |
