(2R,3E)-5-(3-Formyl-2,6-Dihydroxy-4-Methylphenyl)-3-Methyl-1-[(1S,2R,6R)-1,2,6-Trimethyl-3-Oxocyclohexyl]-3-Penten-2-Yl Propionate

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Properties Simple | Detailed

Formula C26H36O6
IUPAC Name [(e,1r)-4-[2,6-dihydroxy-4-methyl-3-(oxomethyl)phenyl]-2-methyl-1-[[(1s,2r,6r)-1,2,6-trimethyl-3-oxo-cyclohexyl]methyl]but-2-enyl] propanoate
Molecular Mass 444.560 g·mol−1
Heat of Formation -1120.7 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 547.24 Å 3
Surface Area 394.84 Å 2
Point Group Symmetry C1
Synonyms
  • [(e,1r)-4-(3-formyl-2,6-dihydroxy-4-methyl-phenyl)-2-methyl-1-[[(1s,2r,6r)-1,2,6-trimethyl-3-oxo-cyclohexyl]methyl]but-2-enyl] propanoate
  • [(e,2r)-5-(2,6-dihydroxy-3-methanoyl-4-methyl-phenyl)-3-methyl-1-[(1s,2r,6r)-1,2,6-trimethyl-3-oxo-cyclohexyl]pent-3-en-2-yl] propanoate
  • [(e,2r)-5-(3-formyl-2,6-dihydroxy-4-methylphenyl)-3-methyl-1-[(1s,2r,6r)-1,2,6-trimethyl-3-oxocyclohexyl]pent-3-en-2-yl] propanoate
  • propanoic acid [(e,1r)-4-(3-formyl-2,6-dihydroxy-4-methylphenyl)-2-methyl-1-[[(1s,2r,6r)-1,2,6-trimethyl-3-oxocyclohexyl]methyl]but-2-enyl] ester
  • propionic acid [(e,1r)-4-(3-formyl-2,6-dihydroxy-4-methyl-phenyl)-1-[[(1s,2r,6r)-3-keto-1,2,6-trimethyl-cyclohexyl]methyl]-2-methyl-but-2-enyl] ester
InChIKey VLFRJRBSRCFKPU-AXNCTASFSA-N
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