(1S,2E,6E,8R,10Z,14R)-8-Hydroxy-3,7,11,15,15-Pentamethylbicyclo[12.1.0]Pentadeca-2,6,10-Triene-4,9-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C20H28O3
IUPAC Name (1r,4z,7r,8e,12e,14s)-7-hydroxy-4,8,12,15,15-pentamethyl-bicyclo[12.1.0]pentadeca-4,8,12-triene-6,11-dione
Molecular Mass 316.435 g·mol−1
Heat of Formation -479.2 ± 16.7 kJ·mol−1
Dipole Moment 4.73 ± 1.08 D
Volume 420.22 Å 3
Surface Area 316.37 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,4z,7r,8e,12e,14s)-7-hydroxy-4,8,12,15,15-pentamethyl-bicyclo[12.1.0]pentadeca-4,8,12-triene-6,11-dione
  • (1r,4z,7r,8e,12e,14s)-7-hydroxy-4,8,12,15,15-pentamethyl-bicyclo[12.1.0]pentadeca-4,8,12-triene-6,11-quinone
  • (1r,4z,7r,8e,12e,14s)-7-hydroxy-4,8,12,15,15-pentamethylbicyclo[12.1.0]pentadeca-4,8,12-triene-6,11-dione
  • koumbalone a
InChIKey YHGZVLAKJHCQTC-FNATTYBVSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O