Glycoside

GD137834
Name:
(11e,13e)â€7,16â€diethylâ€4,6â€dihydroxyâ€15â€{[(5†hydroxyâ€3,4â€dimethoxyâ€6â€methyloxanâ€2†yl)oxy]methyl}â€5,9,13â€trimethylâ€1â€oxacyclohexadeca†11,13â€dieneâ€2,10â€dioneFormula:
C31H52O10Smiles:
CCC1CC(C)C(=O)C=CC(C)=CC(COC2OC(C)C(O)C(OC)C2OC)C(CC)OC(=O)CC(O)C(C)C1OAglycone:
CCC1CC(C)C(=O)C=CC(C)=CC(CO)C(CC)OC(=O)CC(O)C(C)C1OSugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
HBA: | 10 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.81 |
AlogP: | 2.96 | Num_rotatable_bonds: | 7 |
MolWt: | 584.75 | Num_heavy_atoms: | 41 |
TPSA: | 140.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD02950
Formula: C23H38O6
Smiles:
CCC1CC(C)C(=O)C=CC(C)=CC(CO)C(CC)OC(=O)CC(O)C(C)C1OHBA: | 6 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.74 |
AlogP: | 2.8 | Num_rotatable_bonds: | 3 |
MolWt: | 410.55 | Num_heavy_atoms: | 29 |
TPSA: | 104.06 | NumAromaticRings: | 0 |