5-Deoxy-1-O-(2,4-Dihydroxy-6-Methylbenzoyl)-L-Ribulose

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Properties Simple | Detailed

Formula C13H16O7
IUPAC Name [(3s,4s)-3,4-dihydroxy-2-oxo-pentyl] 2,4-dihydroxy-6-methyl-benzoate
Molecular Mass 284.262 g·mol−1
Heat of Formation -1262.4 ± 16.7 kJ·mol−1
Dipole Moment 2.99 ± 1.08 D
Volume 319.88 Å 3
Surface Area 285.23 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 2.48 ± eV
Point Group Symmetry C1
InChIKey QKZBVIRYEJQQDG-MADCSZMMSA-N
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Elements H C O