Glycoside
GD038885
Name:
(2~{s},3~{s},4~{r},5~{s},6~{s})-2-[[(2~{s},4~{r},6~{r})-2-(hydroxymethyl)-6-oxidanyl-oxan-4-yl]methyl]-6-methyl-oxane-3,4,5-triolFormula:
C13H24O7Smiles:
C[C@H]1O[C@H](C[C@@H]2C[C@@H](CO)O[C@@H](O)C2)[C@H](O)[C@H](O)[C@@H]1OAglycone:
CC1CC(O)OC(CO)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.33 | Num_heavy_atoms: | 20 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD24168
Formula: C7H14O3
Smiles:
CC1CC(O)OC(CO)C1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 146.19 | Num_heavy_atoms: | 10 |
| TPSA: | 49.69 | NumAromaticRings: | 0 |
