(3α,4Beta,8α,12R)-3-Hydroxy-12,13-Epoxytrichothec-9-Ene-4,8,15-Triyl Triacetate

Molecule SVG Image

Properties Simple | Detailed

Formula C21H28O9
IUPAC Name (3alpha,4beta,8alpha,12r)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
Molecular Mass 424.442 g·mol−1
Heat of Formation -1516.0 ± 16.7 kJ·mol−1
Dipole Moment 2.04 ± 1.08 D
Volume 480.69 Å 3
Surface Area 376.51 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 0.65 ± eV
Point Group Symmetry C1
InChIKey BIQPSTSCCIEMEI-KTYIDKBESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O