(3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Piperidinone

Molecule SVG Image

Properties Simple | Detailed

Formula C6H11NO5
IUPAC Name (3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidin-2-one
Molecular Mass 177.155 g·mol−1
Heat of Formation -926.3 ± 16.7 kJ·mol−1
Dipole Moment 3.64 ± 1.08 D
Volume 196.03 Å 3
Surface Area 186.05 Å 2
HOMO Energy -10.30 ± 0.55 eV
LUMO Energy 0.60 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidin-2-one
  • (3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylol-2-piperidone
  • 2-piperidinone, 3,4,5-trihydroxy-6-(hydroxymethyl)-, (3r-(3alpha,4beta,5alpha,6beta))-
  • 3,4,5-trihydroxy-6-(hydroxymethyl)-2-piperidone
  • 5-amino-5-deoxy-d-gluconic acid delta-lactam
  • 5-amino-5-deoxygluconic acid delta-lactam
CAS Number(s)
  • 14904-83-7
  • 19130-99-5
  • 53776-94-6
InChIKey AJJXPYDGVXIEHE-SQOUGZDYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N