Glycoside
GD124686
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl heptanoateFormula:
C13H24O7Smiles:
CCCCCCC(=O)OC1OC(CO)C(O)C(O)C1OAglycone:
CCCCCCC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 7 |
| MolWt: | 292.33 | Num_heavy_atoms: | 20 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD03255
Formula: C7H14O2
Smiles:
CCCCCCC(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 130.19 | Num_heavy_atoms: | 9 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
