(3S,4S,5R,6R)-6-Acetamido-4,5-Dihydroxy-3-Piperidinecarboxylic Acid

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Properties Simple | Detailed

Formula C8H14N2O5
IUPAC Name (3s,4s,5r,6r)-6-acetamido-4,5-dihydroxy-piperidine-3-carboxylic acid
Molecular Mass 218.207 g·mol−1
Heat of Formation -983.0 ± 16.7 kJ·mol−1
Dipole Moment 5.59 ± 1.08 D
Volume 242.9 Å 3
Surface Area 226.02 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy 0.64 ± eV
Point Group Symmetry C1
Synonyms
  • (3s, 4s, 5r, 6r)-6-(acetylamino)-4,5-dihydroxy-3-piperidinecarboxylic acid
  • (3s,4s,5r,6r)-6-acetamido-4,5-dihydroxy-nipecotic acid
  • (3s,4s,5r,6r)-6-acetamido-4,5-dihydroxy-piperidine-3-carboxylic acid
  • (3s,4s,5r,6r)-6-acetamido-4,5-dihydroxypiperidine-3-carboxylic acid
  • 3-piperidinecarboxylic acid, 6-(acetylamino)-4,5-dihydroxy-, (3s-(3-alpha,4-alpha,5-alpha,6-beta))-
  • siastatin b
  • siastatin b microbial
CAS Number(s)
  • 54795-58-3
InChIKey DQTKLICLJUKNCG-ZTYPAOSTSA-N
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