(6R)-3-Deoxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-α-L-Threo-Hex-2-Ulopyranosonic Acid

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Properties Simple | Detailed

Formula C9H16O9
IUPAC Name (2s,4s,5r,6r)-2,4,5-trihydroxy-6-[(1r,2r)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid
Molecular Mass 268.218 g·mol−1
Heat of Formation -1726.6 ± 16.7 kJ·mol−1
Dipole Moment 1.61 ± 1.08 D
Volume 291.18 Å 3
Surface Area 256.73 Å 2
HOMO Energy -10.60 ± 0.55 eV
LUMO Energy 0.22 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4s,5r,6r)-2,4,5-trihydroxy-6-[(1r,2r)-1,2,3-trihydroxypropyl]-2-tetrahydropyrancarboxylic acid
  • (2s,4s,5r,6r)-2,4,5-trihydroxy-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
  • (2s,4s,5r,6r)-2,4,5-trihydroxy-6-[(1r,2r)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid
InChIKey CLRLHXKNIYJWAW-YOQZMRDMSA-N
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