(3β,4Alpha,8Alpha,12Xi)-3,15-Diacetoxy-4-Hydroxy-12,13-Epoxytrichothec-9-En-8-Yl 3-Hydroxy-3-Methylbutanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C24H34O10
IUPAC Name [(1s,2r,4s,7r,9r,10r,11s,12s)-10-acetoxy-2-(acetoxymethyl)-11-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-hydroxy-3-methyl-butanoate
Molecular Mass 482.521 g·mol−1
Heat of Formation -1693.8 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 558.76 Å 3
Surface Area 417.73 Å 2
HOMO Energy -9.99 ± 0.55 eV
LUMO Energy 3.35 ± eV
Point Group Symmetry C1
InChIKey FOHUQNSVOKPYSD-FGWLDHMRSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O