Glycoside
GD032618
Name:
NoneFormula:
C24H30O9Smiles:
CCOc1ccc(CCC(=O)c2c(O)cc(C)cc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
CCOc1ccc(CCC(=O)c2c(O)cc(C)cc2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 9 |
| MolWt: | 462.5 | Num_heavy_atoms: | 33 |
| TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD20893
Formula: C18H20O4
Smiles:
CCOc1ccc(CCC(=O)c2c(O)cc(C)cc2O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.28 |
| AlogP: | 3.62 | Num_rotatable_bonds: | 6 |
| MolWt: | 300.35 | Num_heavy_atoms: | 22 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
