2,16-Dihydroxypimara-1,8(14)-Diene-3,15-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C20H28O4
IUPAC Name (4ar,4bs,7r,10ar)-3-hydroxy-7-(2-hydroxyacetyl)-1,1,4a,7-tetramethyl-4b,5,6,9,10,10a-hexahydrophenanthren-2-one
Molecular Mass 332.434 g·mol−1
Heat of Formation -737.4 ± 16.7 kJ·mol−1
Dipole Moment 3.61 ± 1.08 D
Volume 411.36 Å 3
Surface Area 325.98 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
Synonyms
  • (4ar,4bs,7r,10ar)-3-hydroxy-7-(2-hydroxy-1-oxoethyl)-1,1,4a,7-tetramethyl-4b,5,6,9,10,10a-hexahydrophenanthren-2-one
  • (4ar,4bs,7r,10ar)-3-hydroxy-7-(2-hydroxyacetyl)-1,1,4a,7-tetramethyl-4b,5,6,9,10,10a-hexahydrophenanthren-2-one
  • (4ar,4bs,7r,10ar)-3-hydroxy-7-(2-hydroxyethanoyl)-1,1,4a,7-tetramethyl-4b,5,6,9,10,10a-hexahydrophenanthren-2-one
  • (4ar,4bs,7r,10ar)-7-glycoloyl-3-hydroxy-1,1,4a,7-tetramethyl-4b,5,6,9,10,10a-hexahydrophenanthren-2-one
InChIKey JLXLDXALELIBKS-DZXDFRQDSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O