Glycoside
GD131260
Name:
3,4,5-trihydroxy-6-[4-(5-hydroxy-3-oxodecyl)-2-methoxyphenoxy]oxane-2-carboxylic acidFormula:
C23H34O10Smiles:
CCCCCC(O)CC(=O)CCc1ccc(OC2OC(C(=O)O)C(O)C(O)C2O)c(OC)c1Aglycone:
CCCCCC(O)CC(=O)CCc1ccc(O)c(OC)c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 13 |
| MolWt: | 470.52 | Num_heavy_atoms: | 33 |
| TPSA: | 162.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD53183
Formula: C17H26O4
Smiles:
CCCCCC(O)CC(=O)CCc1ccc(O)c(OC)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.59 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 10 |
| MolWt: | 294.39 | Num_heavy_atoms: | 21 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
