6-[(3R,4R,5R)-3,4,5-Trihydroxy-2-(Hydroxymethyl)-1-Piperidinyl]Hexanoic Acid

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Properties Simple | Detailed

Formula C12H23NO6
IUPAC Name 6-[(1s,2r,3r,4s,5r)-3,4,5-trihydroxy-2-(hydroxymethyl)-1-piperidyl]hexanoic acid
Molecular Mass 277.314 g·mol−1
Heat of Formation -1241.8 ± 16.7 kJ·mol−1
Dipole Moment 3.10 ± 1.08 D
Volume 339.02 Å 3
Surface Area 296.06 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy 0.55 ± eV
Point Group Symmetry C1
InChIKey KTNVTDIFZTZBJY-IQIPOGNMSA-N
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