(1R)-1,5-Anhydro-3,4-Di-O-Benzyl-2-O-(2-Benzylbenzyl)-1-[(2E)-2,4-Pentadien-1-Yl]-D-Glucitol

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Properties Simple | Detailed

Formula C39H42O5
IUPAC Name [(2r,3r,4r,5s,6r)-3,4-dibenzyloxy-5-[(2-benzylphenyl)methoxy]-6-[(2e)-penta-2,4-dienyl]tetrahydropyran-2-yl]methanol
Molecular Mass 590.748 g·mol−1
Heat of Formation -441.8 ± 16.7 kJ·mol−1
Dipole Moment 3.49 ± 1.08 D
Volume 756.82 Å 3
Surface Area 587.61 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(tetra-o-benzyl-alpha-glucopyranosyl)-1,3-pentadiene
  • [(2r,3r,4r,5s,6r)-5-[2-(benzyl)benzyl]oxy-3,4-bis(benzyloxy)-6-[(2e)-penta-2,4-dienyl]tetrahydropyran-2-yl]methanol
  • [(2r,3r,4r,5s,6r)-6-[(2e)-penta-2,4-dienyl]-3,4-bis(phenylmethoxy)-5-[[2-(phenylmethyl)phenyl]methoxy]-2-tetrahydropyranyl]methanol
  • [(2r,3r,4r,5s,6r)-6-[(2e)-penta-2,4-dienyl]-3,4-bis(phenylmethoxy)-5-[[2-(phenylmethyl)phenyl]methoxy]oxan-2-yl]methanol
  • [(2r,3r,4r,5s,6r)-6-[(2e)-penta-2,4-dienyl]-3,4-bis(phenylmethoxy)-5-[[2-(phenylmethyl)phenyl]methoxy]tetrahydropyran-2-yl]methanol
  • tetrabenzyl-glu-pentadiene
CAS Number(s)
  • 125365-10-8
InChIKey FJEYHLHWDHWCGC-AWGAJALQSA-N
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