Glycoside
GD001079
Name:
NoneFormula:
C11H14O6NSmiles:
O=C(O)c1ccc[n+]([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1Aglycone:
O=C(O)c1ccc[nH+]c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.23 | Num_heavy_atoms: | 18 |
| TPSA: | 111.1 | NumAromaticRings: | 1 |
Unique Aglycone
AD01127
Formula: C6H6O2N
Smiles:
O=C(O)c1ccc[nH+]c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 1 |
| MolWt: | 124.12 | Num_heavy_atoms: | 9 |
| TPSA: | 51.44 | NumAromaticRings: | 1 |
