(5β,8Alpha,9β,10Alpha,13Alpha)-16-Hydroxy-18-Oxokauran-17-Yl Acetate

Molecule SVG Image

Properties Simple | Detailed

Formula C22H34O4
IUPAC Name [(1r,4s,5r,9s,10r,13s,14s)-5-formyl-14-hydroxy-5,9-dimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate
Molecular Mass 362.503 g·mol−1
Heat of Formation -917.0 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 450.75 Å 3
Surface Area 339.44 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 0.94 ± eV
Point Group Symmetry C1
InChIKey FCHGRGOUMXZTFS-OVMODOJMSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O