Glycoside
GD018358
Name:
NoneFormula:
C13H16O8NSmiles:
Nc1ccc(C(=O)[O-])c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
Nc1ccc(C(=O)[O-])c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -3.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 314.27 | Num_heavy_atoms: | 22 |
| TPSA: | 165.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD12966
Formula: C7H6O3N
Smiles:
Nc1ccc(C(=O)[O-])c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 1 |
| MolWt: | 152.13 | Num_heavy_atoms: | 11 |
| TPSA: | 86.38 | NumAromaticRings: | 1 |
