Glycoside
GD024991
Name:
NoneFormula:
C27H31O6ClSmiles:
C#CCOCCc1cc(Cl)c(Cc2ccc(CC)cc2)cc1[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
C#CCOCCc1ccc(Cc2ccc(CC)cc2)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | 2.2 | Num_rotatable_bonds: | 9 |
| MolWt: | 474.98 | Num_heavy_atoms: | 33 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD16617
Formula: C21H21OCl
Smiles:
C#CCOCCc1ccc(Cc2ccc(CC)cc2)c(Cl)c1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 4.69 | Num_rotatable_bonds: | 7 |
| MolWt: | 312.84 | Num_heavy_atoms: | 22 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
