Glycoside
GD005631
Name:
NoneFormula:
C16H27O12SSmiles:
CO[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CSC(C)C(=O)[O-])[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1OAglycone:
CSC(C)C(=O)[O-]Sugarmoiety:
COC1OC(CO)C(OC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.94 |
| AlogP: | -4.86 | Num_rotatable_bonds: | 8 |
| MolWt: | 443.45 | Num_heavy_atoms: | 29 |
| TPSA: | 198.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD04755
Formula: C4H7O2S
Smiles:
CSC(C)C(=O)[O-]| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 119.16 | Num_heavy_atoms: | 7 |
| TPSA: | 40.13 | NumAromaticRings: | 0 |
