Aphadilactone C

For Research Use Only.
Category
Diterpenoids
Cat.No.
NP1783
CAS
1522004-70-1
Product Name
Aphadilactone C
Structure

Product Details

Description
Aphadilactone C is a natural diterpenoid compound found in several plants.
Synonyms
(6S,6'S)-6,6'-((1E,1'E)-((4S,7S)-4-(5,5-dimethyl-4-oxo-4,5-dihydrofuran-2-yl)-2,2-dimethyl-3-oxo-2,3,4,5,6,7-hexahydrobenzofuran-4,7-diyl)bis(2-methylpent-1-ene-5,1-diyl))bis(4-methyl-5,6-dihydro-2H-pyran-2-one)
IUPAC Name
(4S,7S)-4-(5,5-dimethyl-4-oxofuran-2-yl)-2,2-dimethyl-4,7-bis[(E)-4-methyl-5-[(2S)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]pent-4-enyl]-6,7-dihydro-5H-1-benzofuran-3-one
Molecular Weight
660.84
Molecular Formula
C40H52O8
Canonical SMILES
CC1=CC(=O)OC(C1)C=C(C)CCCC2CCC(C3=C2OC(C3=O)(C)C)(CCCC(=CC4CC(=CC(=O)O4)C)C)C5=CC(=O)C(O5)(C)C
InChI
InChI=1S/C40H52O8/c1-24(17-29-19-26(3)21-33(42)45-29)11-9-13-28-14-16-40(32-23-31(41)38(5,6)47-32,35-36(28)48-39(7,8)37(35)44)15-10-12-25(2)18-30-20-27(4)22-34(43)46-30/h17-18,21-23,28-30H,9-16,19-20H2,1-8H3/b24-17+,25-18+/t28-,29+,30+,40+/m0/s1
InChIKey
ZFQFRRMVMSIOAK-DZSKZOOYSA-N
Purity
>95%
Density
1.2±0.1 g/cm3
Appearance
Oil
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