Hyperatomarin

Molecule SVG Image

Properties Simple | Detailed

Formula C25H36O4
IUPAC Name (1r,5r,7r,8s)-4-hydroxy-8-methyl-7-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-3-(2-methylpropanoyl)bicyclo[3.3.1]non-3-ene-2,9-dione
Molecular Mass 400.551 g·mol−1
Heat of Formation -781.9 ± 16.7 kJ·mol−1
Dipole Moment 6.84 ± 1.08 D
Volume 526.01 Å 3
Surface Area 414.72 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,5r,7r,8s)-4-hydroxy-3-isobutyryl-8-methyl-7-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)bicyclo[3.3.1]non-3-ene-2,9-quinone
  • (1r,5r,7r,8s)-4-hydroxy-8-methyl-7-(3-methylbut-2-enyl)-3-(2-methyl-1-oxopropyl)-8-(4-methylpent-3-enyl)bicyclo[3.3.1]non-3-ene-2,9-dione
InChIKey BIDDBOYBPSUMIT-QNRRCFITSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O