3,5-Dihydroxy-2-Isobutyryl-6,6-Dimethyl-4-[2,4,6-Trihydroxy-3-Methyl-5-(2-Methylbutanoyl)Benzyl]-2,4-Cyclohexadien-1-One
Properties
Property | Value |
---|---|
Formula | C25H32O8 |
IUPAC Name | 3,5-dihydroxy-6,6-dimethyl-2-(2-methylpropanoyl)-4-[[2,4,6-trihydroxy-3-methyl-5-[(2r)-2-methylbutanoyl]phenyl]methyl]cyclohexa-2,4-dien-1-one |
Molecular Mass | 460.517 g·mol−1 |
Heat of Formation | -1541.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.17 ± 1.08 D |
Volume | 546.94 Å 3 |
Surface Area | 400.6 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | 2.25 ± eV |
Point Group Symmetry | C1 |
InChIKey | XEWUKGNAGYTTTK-LLVKDONJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |