Glycoside
GD025910
Name:
NoneFormula:
C22H23O6ClSSmiles:
CS[C@@H]1O[C@H](c2ccc(Cl)c(Cc3ccc4c(c3)OCCO4)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccccc1Cc1ccc2c(c1)OCCO2Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 438.93 | Num_heavy_atoms: | 29 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD08417
Formula: C16H13O2Cl
Smiles:
Clc1ccccc1Cc1ccc2c(c1)OCCO2| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 2 |
| MolWt: | 260.72 | Num_heavy_atoms: | 18 |
| TPSA: | 18.46 | NumAromaticRings: | 2 |
