Glycoside
GD032689
Name:
NoneFormula:
C22H30O5SSmiles:
Cc1cc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)sc1Cc1ccc(C(C)(C)C)cc1Aglycone:
Cc1ccsc1Cc1ccc(C(C)(C)C)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 406.54 | Num_heavy_atoms: | 28 |
| TPSA: | 90.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD20927
Formula: C16H20S
Smiles:
Cc1ccsc1Cc1ccc(C(C)(C)C)cc1| HBA: | 0 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.38 |
| AlogP: | 4.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.4 | Num_heavy_atoms: | 17 |
| TPSA: | 0.0 | NumAromaticRings: | 2 |
