Glycoside
GD031605
Name:
NoneFormula:
C12H21O7SSmiles:
O=C([O-])CCCCCS[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=C([O-])CCCCCSSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 8 |
| MolWt: | 309.36 | Num_heavy_atoms: | 20 |
| TPSA: | 130.28 | NumAromaticRings: | 0 |
Unique Aglycone
AD20347
Formula: C6H11O2S
Smiles:
O=C([O-])CCCCCS| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.83 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 5 |
| MolWt: | 147.22 | Num_heavy_atoms: | 9 |
| TPSA: | 40.13 | NumAromaticRings: | 0 |
