Glycoside
GD072579
Name:
NoneFormula:
C18H25O9NSmiles:
COc1cc(/C=C/C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc(OC)c1OCAglycone:
COc1cc(C=CC(N)=O)cc(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.36 | Num_rotatable_bonds: | 7 |
| MolWt: | 399.4 | Num_heavy_atoms: | 28 |
| TPSA: | 146.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD22179
Formula: C12H15O4N
Smiles:
COc1cc(C=CC(N)=O)cc(OC)c1OC| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 237.25 | Num_heavy_atoms: | 17 |
| TPSA: | 70.78 | NumAromaticRings: | 1 |
