3,5-Dihydroxy-2-Isobutyryl-6,6-Dimethyl-4-(2,4,6-Trihydroxy-3-Isobutyryl-5-Methylbenzyl)-2,4-Cyclohexadien-1-One
Properties
Property | Value |
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Formula | C24H30O8 |
IUPAC Name | (1r,5s)-5-[[2,6-dihydroxy-3,3-dimethyl-5-(2-methylpropanoyl)-4-oxo-cyclohexa-1,5-dien-1-yl]methyl]-1-methyl-3-(oxomethylene)bicyclo[3.1.0]hexane-2,4,6-trione; prop-1-ene |
Molecular Mass | 446.490 g·mol−1 |
Heat of Formation | -1485.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.22 ± 1.08 D |
Volume | 530.96 Å 3 |
Surface Area | 418.25 Å 2 |
HOMO Energy | -8.96 ± 0.55 eV |
LUMO Energy | -0.60 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | QNAVIUVOJCTDPT-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |