AC1NQO00
[1-[5-(5-tert-butylsulfanyl-3-hydroxy-4-methyl-5-oxopentan-2-yl)-2,2,4-trimethyl-1,3-dioxolan-4-yl]-4-[5-[1-(methoxymethoxy)propyl]-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-methylpentan-3-yl] acetate
Also Known As: [1-[5-(5-tert-butylsulfanyl-3-hydroxy-4-methyl-5-oxopentan-2-yl)-2,2,4-trimethyl-1,3-dioxolan-4-yl]-4-[5-[1-(methoxymethoxy)propyl]-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-methylpentan-3-yl] acetate|1-{5-[5-(tert-Butylsulfanyl)-3-hydroxy-4-methyl-5-oxopentan-2-yl]-2,2,4-trimethyl-1,3-dioxolan-4-yl}-4-{5-[1-(methoxymethoxy)propyl]-2,2,5-trimethyl-1,3-dioxolan-4-yl}-2-methylpentan-3-yl acetate
| Molecular Formula | C35H64O10S |
|---|---|
| Molecular Weight | 676.422 g/mol |
| LogP | 6.4913 |
| Topological Polar Surface Area | 118.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 15 |
| Exact Mass | 676.422 |
| Monoisotopic Mass | 676.422 |
| Heavy Atoms | 46 |
| Complexity | 1027.3384 |
Chemical Identifiers
| CAS Number | 7235-83-8 |
|---|---|
| SMILES | CCC(C1(C(OC(O1)(C)C)C(C)C(C(C)CC2(C(OC(O2)(C)C)C(C)C(C(C)C(=O)SC(C)(C)C)O)C)OC(=O)C)C)OCOC |
Product Overview
AC1NQO00 (CAS 7235-83-8), with molecular formula C35H64O10S and molecular weight 676.422 g/mol. IUPAC: [1-[5-(5-tert-butylsulfanyl-3-hydroxy-4-methyl-5-oxopentan-2-yl)-2,2,4-trimethyl-1,3-dioxolan-4-yl]-4-[5-[1-(methoxymethoxy)propyl]-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-methylpentan-3-yl] acetate.
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