Glycoside
GD009431
Name:
LONIJAPOSIDE KFormula:
C23H27O11NSmiles:
C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1C=Cc1ccc[n+](CC(=O)O)c1Aglycone:
C=CC1C(O)OC=C(C(=O)[O-])C1C=Cc1ccc[n+](CC(=O)O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 9 |
| MolWt: | 493.47 | Num_heavy_atoms: | 35 |
| TPSA: | 189.92 | NumAromaticRings: | 1 |
Unique Aglycone
AD07395
Formula: C17H17O6N
Smiles:
C=CC1C(O)OC=C(C(=O)[O-])C1C=Cc1ccc[n+](CC(=O)O)c1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 331.32 | Num_heavy_atoms: | 24 |
| TPSA: | 110.77 | NumAromaticRings: | 1 |
