2-Acetyl-4-[3-Acetyl-2,4,6-Trihydroxy-5-(3-Methyl-2-Buten-1-Yl)Benzyl]-3,5-Dihydroxy-6-Methyl-6-(3-Methyl-2-Buten-1-Yl)-2,4-Cyclohexadien-1-One

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Properties Simple | Detailed

Formula C28H34O8
IUPAC Name (6r)-2-acetyl-4-[[3-acetyl-2,4,6-trihydroxy-5-(3-methylbut-2-enyl)phenyl]methyl]-3,5-dihydroxy-6-methyl-6-(3-methylbut-2-enyl)cyclohexa-2,4-dien-1-one
Molecular Mass 498.565 g·mol−1
Heat of Formation -1431.8 ± 16.7 kJ·mol−1
Dipole Moment 7.85 ± 1.08 D
Volume 600.95 Å 3
Surface Area 473.08 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy 2.31 ± eV
Point Group Symmetry C1
InChIKey IDWYGCPWMNLBEA-NDEPHWFRSA-N
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Elements H C O