Glycoside
GD006028
Name:
NoneFormula:
C21H28O5SSmiles:
CCc1ccc(Cc2sc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(C)c2C)cc1Aglycone:
CCc1ccc(Cc2scc(C)c2C)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 392.52 | Num_heavy_atoms: | 27 |
| TPSA: | 90.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD05027
Formula: C15H18S
Smiles:
CCc1ccc(Cc2scc(C)c2C)cc1| HBA: | 0 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 4.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 230.38 | Num_heavy_atoms: | 16 |
| TPSA: | 0.0 | NumAromaticRings: | 2 |
