Glycoside
GD115903
Name:
Paeciloside AFormula:
C14H20O8Smiles:
Cc1c(O)cc(O)c(C(=O)OCC(O)C(O)C(O)CO)c1CAglycone:
Cc1c(O)cc(O)c(C=O)c1CSugarmoiety:
OCC(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 316.31 | Num_heavy_atoms: | 22 |
| TPSA: | 147.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD45931
Formula: C9H10O3
Smiles:
Cc1c(O)cc(O)c(C=O)c1C| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 166.18 | Num_heavy_atoms: | 12 |
| TPSA: | 57.53 | NumAromaticRings: | 1 |
