B,B-Trehalose

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Properties Simple | Detailed

Formula C12H22O11
IUPAC Name (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-3,4,5-triol
Molecular Mass 342.296 g·mol−1
Heat of Formation -2052.7 ± 16.7 kJ·mol−1
Dipole Moment 5.07 ± 1.08 D
Volume 379.17 Å 3
Surface Area 320.68 Å 2
HOMO Energy -10.65 ± 0.55 eV
LUMO Energy 3.79 ± eV
Point Group Symmetry C2
Synonyms
  • (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxane-3,4,5-triol
  • (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol
  • (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-3,4,5-triol
  • (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]tetrahydropyran-3,4,5-triol
  • (2r,3s,4s,5r,6s)-2-methylol-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-3,4,5-triol
  • beta,beta-trehalose
  • beta-d-glcp-(1<->1)-beta-d-glcp
  • beta-d-glucopyranosyl beta-d-glucopyranoside
InChIKey HDTRYLNUVZCQOY-NCFXGAEVSA-N
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