Glycoside
GD035630
Name:
NoneFormula:
C23H25O8ClSmiles:
COc1cc(Cl)c(Cc2ccc3c(c2)OCCO3)cc1[C@@H]1O[C@H](OC)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1ccc(Cc2ccc3c(c2)OCCO3)c(Cl)c1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 5 |
| MolWt: | 452.89 | Num_heavy_atoms: | 31 |
| TPSA: | 106.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD22534
Formula: C17H15O3Cl
Smiles:
COc1ccc(Cc2ccc3c(c2)OCCO3)c(Cl)c1| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 3.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 290.75 | Num_heavy_atoms: | 20 |
| TPSA: | 27.69 | NumAromaticRings: | 2 |
