Glycoside
GD025681
Name:
NoneFormula:
C19H23O9NSmiles:
COc1cc(-c2c(O)ccn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2=O)cc(OC)c1OCAglycone:
COc1cc(-c2c(O)cc[nH]c2=O)cc(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 409.39 | Num_heavy_atoms: | 29 |
| TPSA: | 139.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD17005
Formula: C14H15O5N
Smiles:
COc1cc(-c2c(O)cc[nH]c2=O)cc(OC)c1OC| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 277.28 | Num_heavy_atoms: | 20 |
| TPSA: | 80.78 | NumAromaticRings: | 2 |
