Glycoside
GD113016
Name:
NoneFormula:
C26H18O8Cl4Smiles:
CCOC(=O)[C@H](OC(=O)c1ccc(Cl)cc1Cl)[C@@H](OC(=O)c1ccc(Cl)cc1Cl)C(=O)OCCAglycone:
O=Cc1ccc(Cl)cc1Cl.O=Cc1ccc(Cl)cc1ClSugarmoiety:
CCOC(=O)C(OO)C(OO)C(=O)OCCOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.27 |
| AlogP: | 5.18 | Num_rotatable_bonds: | 9 |
| MolWt: | 552.19 | Num_heavy_atoms: | 34 |
| TPSA: | 105.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD44801
Formula: C9H4OCl2
Smiles:
O=Cc1ccc(Cl)cc1Cl| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 175.01 | Num_heavy_atoms: | 10 |
| TPSA: | 17.07 | NumAromaticRings: | 1 |
