Glycoside
GD039329
Name:
(1~{r},3~{s},4~{r},5~{r})-5-[(2~{s},3~{r},4~{s},5~{r})-3,4,5-tris(oxidanyl)oxan-2-yl]oxycyclohexane-1,2,3,4-tetrolFormula:
C11H20O9Smiles:
OC1[C@@H](O)C[C@@H](O[C@H]2OC[C@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1OAglycone:
OC1CC(O)C(O)C(O)C1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -4.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 296.27 | Num_heavy_atoms: | 20 |
| TPSA: | 160.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD24353
Formula: C6H12O5
Smiles:
OC1CC(O)C(O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -2.81 | Num_rotatable_bonds: | 0 |
| MolWt: | 164.16 | Num_heavy_atoms: | 11 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
