Glycoside
GD016640
Name:
NoneFormula:
C14H18O8N2Smiles:
O=C(NC[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1ccc([N+](=O)[O-])cc1Aglycone:
CNC(=O)c1ccc([N+](=O)[O-])cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 342.3 | Num_heavy_atoms: | 24 |
| TPSA: | 162.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD11956
Formula: C8H8O3N2
Smiles:
CNC(=O)c1ccc([N+](=O)[O-])cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 180.16 | Num_heavy_atoms: | 13 |
| TPSA: | 72.24 | NumAromaticRings: | 1 |
