Products 1087072-50-1

CAS 1087072-50-1 appears in our catalog under these names: 1-o-Acetyl-6β-o-isobutyrylbritannilactone, 1-O-Acetyl-6beta-O-Isobutyrylbritannilactone. Offered by: Biosynth, MedChemExpress. Available pack sizes: 50mg, 25mg, 10 mg, 5 mg, 25 mg.

Structural formula: {0} (CAS {1})

[(3aR,4R,7aR)-5-(5-acetyloxypentan-2-yl)-6-methyl-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] 2-methylpropanoate (CAS 1087072-50-1) is a chemical compound with the molecular formula C21H30O6 and a molecular weight of 378.5 g/mol. IUPAC name: [(3aR,4R,7aR)-5-(5-acetyloxypentan-2-yl)-6-methyl-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] 2-methylpropanoate. InChIKey: XHBHYMSLBWDFRZ-MAUKLKHJSA-N.

Identity
Molecular formulaC21H30O6
Molecular weight378.5 g/mol
IUPAC name[(3aR,4R,7aR)-5-(5-acetyloxypentan-2-yl)-6-methyl-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] 2-methylpropanoate
InChIKeyXHBHYMSLBWDFRZ-MAUKLKHJSA-N
SMILESCC1=C([C@@H]([C@H]2[C@@H](C1)OC(=O)C2=C)OC(=O)C(C)C)C(C)CCCOC(=O)C

Computed by PubChem (NCBI)