Glycoside
GD121371
Name:
Patientoside BFormula:
C19H18O7Cl2Smiles:
Cc1c(Cl)c(O)c2c(OC3OC(CO)C(O)C(O)C3O)cccc2c1ClAglycone:
Cc1c(Cl)c(O)c2c(O)cccc2c1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 405.23 | Num_heavy_atoms: | 26 |
| TPSA: | 119.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD48849
Formula: C13H8O2Cl2
Smiles:
Cc1c(Cl)c(O)c2c(O)cccc2c1Cl| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 3.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 243.09 | Num_heavy_atoms: | 15 |
| TPSA: | 40.46 | NumAromaticRings: | 2 |
