[(3S,4R,5S)-5-{[9-(1,3-Benzodioxol-5-Yl)-6,7-Dimethoxy-1-Oxo-1,3-Dihydronaphtho[2,3-C]Furan-4-Yl]Oxy}-3,4-Dihydroxytetrahydro-3-Furanyl]Methyl Acetate

Molecule SVG Image

Properties Simple | Detailed

Formula C28H26O12
IUPAC Name [(3r,4s,5r)-5-[[9-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-1-oxo-3h-benzo[f]isobenzofuran-4-yl]oxy]-3,4-dihydroxy-tetrahydrofuran-3-yl]methyl acetate
Molecular Mass 554.499 g·mol−1
Heat of Formation -1694.3 ± 16.7 kJ·mol−1
Dipole Moment 9.90 ± 1.08 D
Volume 610.63 Å 3
Surface Area 496.25 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy 1.96 ± eV
Point Group Symmetry C1
InChIKey UOOSHUGMIURKRC-BIYCFNCWSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O