3-(1H-Indol-3-Yl)-N-{[(2R,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-2-Piperidinyl]Methyl}Propanamide

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Properties Simple | Detailed

Formula C18H25N3O4
IUPAC Name 3-indol-1-ium-7a-ylium-3-yl-n-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-piperidyl]methyl]propanamide
Molecular Mass 347.409 g·mol−1
Heat of Formation -675.2 ± 16.7 kJ·mol−1
Dipole Moment 4.64 ± 1.08 D
Volume 422.46 Å 3
Surface Area 368.62 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 2.78 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(1h-indol-3-yl)-n-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]methyl]propanamide
  • 3-(1h-indol-3-yl)-n-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-piperidyl]methyl]propanamide
  • 3-(1h-indol-3-yl)-n-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-piperidyl]methyl]propionamide
  • 3-(1h-indol-3-yl)-n-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-piperidin-2-yl]methyl]propanamide
  • 3-(1h-indol-3-yl)-n-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methylpiperidin-2-yl]methyl]propanamide
InChIKey QUTVJEWHGONWDR-YCIWZXPNSA-N
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