6-(2,6-Dihydroxy-3-Isobutyryl-4-Methoxy-5-Methylbenzyl)-3,5-Dihydroxy-2-Isobutyryl-4,6-Dimethyl-2,4-Cyclohexadien-1-One

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Properties Simple | Detailed

Formula C25H32O8
IUPAC Name (6s)-6-[[2,6-dihydroxy-4-methoxy-3-methyl-5-(2-methylpropanoyl)phenyl]methyl]-3,5-dihydroxy-4,6-dimethyl-2-(2-methylpropanoyl)cyclohexa-2,4-dien-1-one
Molecular Mass 460.517 g·mol−1
Heat of Formation -1416.6 ± 16.7 kJ·mol−1
Dipole Moment 5.83 ± 1.08 D
Volume 547.02 Å 3
Surface Area 439.43 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
InChIKey WJMWQOAVNBMCKR-RUZDIDTESA-N
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