(2S)-2-[(1S,3R,4S,4As)-3-Acetoxy-4-Methyl-7-Methylene-1,2,3,4,4A,5,6,7-Octahydro-1-Naphthalenyl]-6-Methyl-4-Oxo-5-Hepten-3-Yl Acetate

Molecule SVG Image

Properties Simple | Detailed

Formula C24H34O5
IUPAC Name [(1s,2r,4s,8as)-4-[(1s,2s)-2-acetoxy-1,5-dimethyl-3-oxo-hex-4-enyl]-1-methyl-6-methylene-2,3,4,7,8,8a-hexahydro-1h-naphthalen-2-yl] acetate
Molecular Mass 402.524 g·mol−1
Heat of Formation -987.8 ± 16.7 kJ·mol−1
Dipole Moment 0.71 ± 1.08 D
Volume 521.38 Å 3
Surface Area 413.82 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
InChIKey GDSJHIMPNZMFSO-WAIFFKHGSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O