Glycoside
GD028624
Name:
2-{2-[2-hydroxy-1,4-bis(hydroxymethyl)cyclohexyl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H30O9Smiles:
OC[C@@H]1CC[C@](CO)(CCO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)C1Aglycone:
OCCC1(CO)CCC(CO)CC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.67 | Num_rotatable_bonds: | 7 |
| MolWt: | 366.41 | Num_heavy_atoms: | 25 |
| TPSA: | 160.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD18683
Formula: C10H20O4
Smiles:
OCCC1(CO)CCC(CO)CC1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 204.27 | Num_heavy_atoms: | 14 |
| TPSA: | 80.92 | NumAromaticRings: | 0 |
