Glycoside
GD003713
Name:
NoneFormula:
C24H32O10S2Smiles:
OC[C@@H]1O[C@H](SCc2ccc(CS[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c3ccccc23)[C@H](O)[C@H](O)[C@H]1OAglycone:
SCc1ccc(CS)c2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.58 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 8 |
| MolWt: | 544.64 | Num_heavy_atoms: | 36 |
| TPSA: | 180.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD03331
Formula: C12H12S2
Smiles:
SCc1ccc(CS)c2ccccc12| HBA: | 0 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 2 |
| MolWt: | 220.36 | Num_heavy_atoms: | 14 |
| TPSA: | 0.0 | NumAromaticRings: | 2 |
