10-Hydroxy-8-[(2R,4S,5R)-5-Hydroxy-4-(Hydroxymethyl)-1,3-Dioxan-2-Yl]-3-Methyl-7-(2-Oxopropyl)-1-Propyl-1H-Benzo[G]Isochromene-6,9-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C25H28O9
IUPAC Name 7-acetonyl-10-hydroxy-8-[5-hydroxy-4-(hydroxymethyl)-1,3-dioxan-2-yl]-3-methyl-1-propyl-1h-benzo[g]isochromene-6,9-dione
Molecular Mass 472.484 g·mol−1
Heat of Formation 1732.2 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 466.78 Å 3
Surface Area 408.3 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -2.79 ± eV
Point Group Symmetry C1
InChIKey UYZRGLQTRZRYKC-FFUKXMTKSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C O