1-{6-[(2E)-3,7-Dimethyl-2,6-Octadien-1-Yl]-5,7-Dihydroxy-8-(2-Methylbutanoyl)-2-Oxo-2H-Chromen-4-Yl}Propyl Acetate

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Properties Simple | Detailed

Formula C29H38O7
IUPAC Name [(1s)-1-[6-[(2e)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-8-[(2r)-2-methylbutanoyl]-2-oxo-chromen-4-yl]propyl] acetate
Molecular Mass 498.608 g·mol−1
Heat of Formation -1365.0 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 618.96 Å 3
Surface Area 450.21 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
InChIKey UTENTZJIWUVVPY-UGEVSEOWSA-N
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