Glycoside
GD036421
Name:
NoneFormula:
C23H25O6ClSmiles:
COc1cc(Cl)c(Cc2ccc3c(c2)CC3)cc1[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1ccc(Cc2ccc3c(c2)CC3)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 5 |
| MolWt: | 420.89 | Num_heavy_atoms: | 29 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD22970
Formula: C17H15OCl
Smiles:
COc1ccc(Cc2ccc3c(c2)CC3)c(Cl)c1| HBA: | 1 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 4.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.75 | Num_heavy_atoms: | 18 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
