Glycoside
GD025781
Name:
SHOMASIDE EFormula:
C25H30O11Smiles:
COc1cc(OC(=O)C=Cc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1CCOAglycone:
COc1cc(C=CC(=O)Oc2ccc(CCO)c(OC)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 10 |
| MolWt: | 506.5 | Num_heavy_atoms: | 36 |
| TPSA: | 164.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD17057
Formula: C19H20O6
Smiles:
COc1cc(C=CC(=O)Oc2ccc(CCO)c(OC)c2)ccc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 2.56 | Num_rotatable_bonds: | 7 |
| MolWt: | 344.36 | Num_heavy_atoms: | 25 |
| TPSA: | 85.22 | NumAromaticRings: | 2 |
