Glycoside
GD013668
Name:
NoneFormula:
C18H30O10SSmiles:
CC1(C)O[C@@H]2[C@H](CS[C@@H]3O[C@H]([C@H](O)CO)[C@H](O)[C@H]3O)O[C@@H]3OC(C)(C)O[C@@H]3[C@@H]2O1Aglycone:
CC1(C)OC2OC(CS)C3OC(C)(C)OC3C2O1Sugarmoiety:
OCC(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 438.5 | Num_heavy_atoms: | 29 |
| TPSA: | 136.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD10159
Formula: C12H20O5S
Smiles:
CC1(C)OC2OC(CS)C3OC(C)(C)OC3C2O1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 1 |
| MolWt: | 276.35 | Num_heavy_atoms: | 18 |
| TPSA: | 46.15 | NumAromaticRings: | 0 |
