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
Properties
Property | Value |
---|---|
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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |