Glycoside
GD003993
Name:
NoneFormula:
C20H21O7ClSmiles:
COc1ccc(-c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(Cl)c2)cc1Aglycone:
COc1ccc(-c2ccc(O)c(Cl)c2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 396.82 | Num_heavy_atoms: | 27 |
| TPSA: | 108.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD03552
Formula: C14H11O2Cl
Smiles:
COc1ccc(-c2ccc(O)c(Cl)c2)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 3.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 234.68 | Num_heavy_atoms: | 16 |
| TPSA: | 29.46 | NumAromaticRings: | 2 |
