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

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Properties Simple | Detailed

Formula C19H26O8
IUPAC Name 3,4,5-trihydroxy-6-[2-(4-isobutylphenyl)propanoyloxy]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
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Elements H C O