Glycoside
GD156205
Name:
butyl 3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanoateFormula:
C14H26O8Smiles:
CCCCOC(=O)CC(C)OC1OC(CO)C(O)C(O)C1OAglycone:
CCCCOC(=O)CC(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 8 |
| MolWt: | 322.35 | Num_heavy_atoms: | 22 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD54539
Formula: C8H16O3
Smiles:
CCCCOC(=O)CC(C)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 160.21 | Num_heavy_atoms: | 11 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
