Glycoside
GD003338
Name:
NoneFormula:
C25H29O6ClSmiles:
OC[C@@H]1O[C@H](c2ccc(Cl)c(Cc3ccc(CCOC4CC4)cc3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccccc1Cc1ccc(CCOC2CC2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 8 |
| MolWt: | 448.94 | Num_heavy_atoms: | 31 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD03040
Formula: C19H19OCl
Smiles:
Clc1ccccc1Cc1ccc(CCOC2CC2)cc1| HBA: | 1 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 4.65 | Num_rotatable_bonds: | 6 |
| MolWt: | 286.8 | Num_heavy_atoms: | 20 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
