Methyl 9-(α-D-Mannopyranosyloxy)Nonanoate

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Formula C16H30O8
IUPAC Name methyl 9-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxynonanoate
Molecular Mass 350.405 g·mol−1
Heat of Formation -1652.7 ± 16.7 kJ·mol−1
Dipole Moment 1.96 ± 1.08 D
Volume 435.3 Å 3
Surface Area 394.02 Å 2
HOMO Energy -10.43 ± 0.55 eV
LUMO Energy 0.77 ± eV
Point Group Symmetry C1
Synonyms
  • 9-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxypelargonic acid methyl ester
  • 9-[[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]nonanoic acid methyl ester
  • methyl 9-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonanoate
  • methyl 9-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxynonanoate
InChIKey ZJZBQHWSENWEMY-VMMWWAARSA-N
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