Glycoside
GD025388
Name:
NoneFormula:
C18H32O14S2Smiles:
OC[C@@H]1O[C@H](S[C@@H]2[C@H](O)[C@H](S[C@@H]3[C@H](O)C(O)O[C@H](CO)[C@H]3O)O[C@H](CO)[C@H]2O)[C@H](O)[C@H](O)[C@H]1OAglycone:
OCC1OC(S)C(O)C(S)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 1.0 |
| AlogP: | -6.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 536.57 | Num_heavy_atoms: | 34 |
| TPSA: | 250.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD00586
Formula: C6H12O4S2
Smiles:
OCC1OC(S)C(O)C(S)C1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 1 |
| MolWt: | 212.29 | Num_heavy_atoms: | 12 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
