1-O-Acetyl-6-O-isobutyrylbritannilactone

For Research Use Only.
Category
Sesquiterpenoids
Cat.No.
NP5990
CAS
1613152-34-3
Product Name
1-O-Acetyl-6-O-isobutyrylbritannilactone
Structure

Product Details

Description
1-O-Acetyl-6-O-isobutyrylbritannilactone is isolated from the flower heads of Inula britannica.
Synonyms
[(3aR,4S,7aR)-5-[(2S)-5-acetyloxypentan-2-yl]-6-methyl-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] 2-methylpropanoate
IUPAC Name
[(3aR,4S,7aR)-5-[(2S)-5-acetyloxypentan-2-yl]-6-methyl-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] 2-methylpropanoate
Molecular Weight
378.465
Molecular Formula
C21H30O6
Canonical SMILES
CC1=C(C(C2C(C1)OC(=O)C2=C)OC(=O)C(C)C)C(C)CCCOC(=O)C
InChI
InChI=1S/C21H30O6/c1-11(2)20(23)27-19-17(12(3)8-7-9-25-15(6)22)13(4)10-16-18(19)14(5)21(24)26-16/h11-12,16,18-19H,5,7-10H2,1-4,6H3/t12-,16+,18+,19+/m0/s1
InChIKey
XHBHYMSLBWDFRZ-ZLKDORHNSA-N
Purity
97.5%
Appearance
Oil
Form
Oil
Packaging
1 mg
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