1,11,12-Trihydroxy-2,16-Dioxo-13,20-Epoxypicras-3-En-15-Yl 2-Methylbutanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C25H14O9
IUPAC Name (1beta,11beta,12alpha,15beta)-1,11,12-trihydroxy-2,16-dioxo-13,20-epoxypicras-3-en-15-yl (2r)-2-methylbutanoate
Molecular Mass 458.373 g·mol−1
Heat of Formation 1478.7 ± 16.7 kJ·mol−1
Dipole Moment 5.69 ± 1.08 D
Volume 458.21 Å 3
Surface Area 413.39 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -2.84 ± eV
Point Group Symmetry C1
InChIKey OKIKYYZNNZCZRX-ZDABEBAYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C O