Glycoside
GD032523
Name:
NoneFormula:
C21H25O7NSmiles:
COC(=O)c1cccc(-c2ccc(NC[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)c1Aglycone:
CNc1ccc(-c2cccc(C(=O)OC)c2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 6 |
| MolWt: | 403.43 | Num_heavy_atoms: | 29 |
| TPSA: | 128.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD20855
Formula: C15H15O2N
Smiles:
CNc1ccc(-c2cccc(C(=O)OC)c2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.13 |
| AlogP: | 3.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 241.29 | Num_heavy_atoms: | 18 |
| TPSA: | 38.33 | NumAromaticRings: | 2 |
