Trehalose 6-Phosphate

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Properties Simple | Detailed

Formula C12H23O14P
IUPAC Name [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl dihydrogen phosphate
Molecular Mass 422.276 g·mol−1
Heat of Formation -2939.4 ± 16.7 kJ·mol−1
Dipole Moment 3.61 ± 1.08 D
Volume 438.61 Å 3
Surface Area 357.26 Å 2
HOMO Energy -10.37 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]methyl dihydrogen phosphate
  • alpha,alpha'-trehalose 6-phosphate
  • alpha-d-glucopyranoside, alpha-d-glucopyranosyl, 6-(dihydrogen phosphate)
  • alpha-d-glucopyranosyl 6-o-phosphono-alpha-d-glucopyranoside
  • alpha-d-glucopyranosyl alpha-d-glucopyranoside 6-(dihydrogen phosphate)
CAS Number(s)
  • 10196-10-8
  • 14752-85-3
InChIKey LABSPYBHMPDTEL-LIZSDCNHSA-N
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