[(1R,7Ar)-1-{[(2Z)-2-Methyl-2-Butenoyl]Oxy}-2,3,5,7A-Tetrahydro-1H-Pyrrolizin-7-Yl]Methyl (2R,3S,4S)-3-Hydroxy-2,4-Dimethyl-5-Oxotetrahydro-3-Furancarboxylate

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Properties Simple | Detailed

Formula C20H27NO7
IUPAC Name [(4r,7r,8r)-7-[(z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3h-pyrrolizin-1-yl]methyl (2r,3s,4s)-3-hydroxy-2,4-dimethyl-5-oxo-tetrahydrofuran-3-carboxylate
Molecular Mass 393.431 g·mol−1
Heat of Formation -1208.1 ± 16.7 kJ·mol−1
Dipole Moment 7.27 ± 1.08 D
Volume 460.99 Å 3
Surface Area 352.12 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -0.07 ± eV
Point Group Symmetry C1
Synonyms
  • (+)-latifoline
  • (2r,3s,4s)-3-hydroxy-2,4-dimethyl-5-oxo-3-tetrahydrofurancarboxylic acid [(7r,8r)-7-[(z)-2-methyl-1-oxobut-2-enoxy]-5,6,7,8-tetrahydro-3h-pyrrolizin-1-yl]methyl ester
  • (2r,3s,4s)-3-hydroxy-5-keto-2,4-dimethyl-tetrahydrofuran-3-carboxylic acid [(7r,8r)-7-[(z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3h-pyrrolizin-1-yl]methyl ester
  • [(7r,8r)-7-[(z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3h-pyrrolizin-1-yl]methyl (2r,3s,4s)-3-hydroxy-2,4-dimethyl-5-oxo-oxolane-3-carboxylate
  • [(7r,8r)-7-[(z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3h-pyrrolizin-1-yl]methyl (2r,3s,4s)-3-hydroxy-2,4-dimethyl-5-oxo-tetrahydrofuran-3-carboxylate
  • [(7r,8r)-7-[(z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3h-pyrrolizin-1-yl]methyl (2r,3s,4s)-3-hydroxy-2,4-dimethyl-5-oxooxolane-3-carboxylate
CAS Number(s)
  • 6029-86-3
InChIKey LZKFLVDOCDILCY-CYSCPGKSSA-N
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