Glycoside
GD017481
Name:
NoneFormula:
C22H26O9N2Smiles:
COc1ccc(OCC(=O)NN=Cc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
COc1ccc(OCC(=O)NN=Cc2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 9 |
| MolWt: | 462.46 | Num_heavy_atoms: | 33 |
| TPSA: | 159.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD12466
Formula: C16H16O4N2
Smiles:
COc1ccc(OCC(=O)NN=Cc2ccc(O)cc2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 6 |
| MolWt: | 300.31 | Num_heavy_atoms: | 22 |
| TPSA: | 80.15 | NumAromaticRings: | 2 |
