Glycoside
GD014587
Name:
NoneFormula:
C27H33O7ClSmiles:
OC[C@@H]1O[C@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CCCC4)cc3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccccc1Cc1ccc(OCCOC2CCCC2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 2.78 | Num_rotatable_bonds: | 9 |
| MolWt: | 493.0 | Num_heavy_atoms: | 34 |
| TPSA: | 108.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD10704
Formula: C21H23O2Cl
Smiles:
Clc1ccccc1Cc1ccc(OCCOC2CCCC2)cc1| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 5.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 330.86 | Num_heavy_atoms: | 23 |
| TPSA: | 18.46 | NumAromaticRings: | 2 |
