Pumiliotoxin 251D

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Properties Simple | Detailed

Formula C16H29NO
IUPAC Name (4s,6z,8s,8as)-8-methyl-6-[(2r)-2-methylhexylidene]-1,2,3,5,7,8a-hexahydroindolizin-8-ol
Molecular Mass 251.408 g·mol−1
Heat of Formation -334.7 ± 16.7 kJ·mol−1
Dipole Moment 2.92 ± 1.08 D
Volume 359.05 Å 3
Surface Area 313.14 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 1.17 ± eV
Point Group Symmetry C1
Synonyms
  • (6z,8s,8as)-8-methyl-6-[(2r)-2-methylhexylidene]-1,2,3,5,7,8a-hexahydroindolizin-8-ol
  • (6z,8s,8as)-8-methyl-6-[(2r)-2-methylhexylidene]indolizidin-8-ol
  • 8-indolizinol, octahydro-8-methyl-6-((2r)-2-methylhexylidene)-, (6z,8s,8as)-
CAS Number(s)
  • 73376-35-9
InChIKey OKTQTXDNHCOLHT-AJKPHIATSA-N
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