Glycoside
GD132892
Name:
2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl hexanoateFormula:
C12H22O7Smiles:
CCCCCC(=O)OC1C(O)C(O)OC(CO)C1OAglycone:
CCCCCC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 6 |
| MolWt: | 278.3 | Num_heavy_atoms: | 19 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD00130
Formula: C6H12O2
Smiles:
CCCCCC(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.83 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 116.16 | Num_heavy_atoms: | 8 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
