Methyl [(1R,5R,6R,13R,14R,16S)-14-Acetoxy-6-(3-Furyl)-1,5,15,15-Tetramethyl-8,17-Dioxo-7-Oxatetracyclo[11.3.1.0~2,11~.0~5,10~]Heptadec-10-En-16-Yl]Acetate

Molecule SVG Image

Properties Simple | Detailed

Formula C29H36O8
IUPAC Name methyl [(1r,5r,6r,13r,14r,16s)-14-acetoxy-6-(3-furyl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.0 2,11 .0 5,10 ]heptadec-10-en-16-yl]acetate
Molecular Mass 512.591 g·mol−1
Heat of Formation -1356.8 ± 16.7 kJ·mol−1
Dipole Moment 5.94 ± 1.08 D
Volume 602.46 Å 3
Surface Area 437.72 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 3.25 ± eV
Point Group Symmetry C1
InChIKey YOTCKRFNSMJTGD-VRYGVUSESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O