AC1Q5UXF
2-(1-acetyloxyethyl)-5-(6-hydroxy-8a-methyl-1-oxo-2,3,4,4a,5,6,7,8-octahydronaphthalen-2-yl)-1-methylcyclopentane-1-carboxylic acid
Also Known As: EINECS 255-173-7|2-[1-(acetyloxy)ethyl]-5-(6-hydroxy-8a-methyl-1-oxodecahydronaphthalen-2-yl)-1-methylcyclopentanecarboxylic acid|2-(1-acetyloxyethyl)-5-(6-hydroxy-8a-methyl-1-oxo-2,3,4,4a,5,6,7,8-octahydronaphthalen-2-yl)-1-methylcyclopentane-1-carboxylic acid|2-(1-acetoxyethyl)-5-(6-hydroxy-8a-methyl-1-oxodecahydronaphthalen-2-yl)-1-methylcyclopentane-1-carboxylic acid|2-[1-(Acetyloxy)ethyl]-5-(6-hydroxy-8a-methyl-1-oxodecahydronaphthalen-2-yl)-1-methylcyclopentane-1-carboxylic acid
| Molecular Formula | C22H34O6 |
|---|---|
| Molecular Weight | 394.23553 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.23553 |
| Monoisotopic Mass | 394.23553 |
| Heavy Atoms | 28 |
| Complexity | 659.0 |
Chemical Identifiers
| CAS Number | 41005-35-0 |
|---|---|
| SMILES | CC(C1CCC(C1(C)C(=O)O)C2CCC3CC(CCC3(C2=O)C)O)OC(=O)C |
| InChIKey | YCENMLSFQOQEHY-UHFFFAOYSA-N |
Product Overview
AC1Q5UXF (CAS 41005-35-0), with molecular formula C22H34O6 and molecular weight 394.23553 g/mol. IUPAC: 2-(1-acetyloxyethyl)-5-(6-hydroxy-8a-methyl-1-oxo-2,3,4,4a,5,6,7,8-octahydronaphthalen-2-yl)-1-methylcyclopentane-1-carboxylic acid.