Glycoside
GD124192
Name:
GenisteoneFormula:
C26H28O10Smiles:
CC(C)=CCc1c(OC2OC(CO)C(O)C(O)C2O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1OAglycone:
CC(C)=CCc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 500.5 | Num_heavy_atoms: | 36 |
| TPSA: | 170.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD50152
Formula: C20H18O5
Smiles:
CC(C)=CCc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 4.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 338.36 | Num_heavy_atoms: | 25 |
| TPSA: | 90.9 | NumAromaticRings: | 3 |
