2-Acetyl-4-[(6-Acetyl-5,7-Dihydroxy-2,2-Dimethyl-2H-Chromen-8-Yl)Methyl]-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 C28H32O8
IUPAC Name (6r)-2-acetyl-4-[(6-acetyl-5,7-dihydroxy-2,2-dimethyl-chromen-8-yl)methyl]-3,5-dihydroxy-6-methyl-6-(3-methylbut-2-enyl)cyclohexa-2,4-dien-1-one
Molecular Mass 496.549 g·mol−1
Heat of Formation -1333.0 ± 16.7 kJ·mol−1
Dipole Moment 10.53 ± 1.08 D
Volume 594.55 Å 3
Surface Area 454.53 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey VVSLJOYXCCVDIR-MUUNZHRXSA-N
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