(5Xi)-1-O-[2-(4-Isobutylphenyl)Propanoyl]-β-L-Lyxo-Hexopyranuronic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C19H26O8
IUPAC Name (2s,3r,4r,5r,6r)-3,4,5-trihydroxy-6-[(2r)-2-(4-isobutylphenyl)propanoyl]oxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 382.405 g·mol−1
Heat of Formation -1506.9 ± 16.7 kJ·mol−1
Dipole Moment 6.21 ± 1.08 D
Volume 451.52 Å 3
Surface Area 342.68 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 0.05 ± eV
Point Group Symmetry C1
InChIKey ABOLXXZAJIAUGR-QYWYZGNRSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O