7-{(2S)-2-[(1E,3R)-3-Hydroxy-1-Octen-1-Yl]-5-Oxo-1-Pyrrolidinyl}Heptanoic Acid

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Properties Simple | Detailed

Formula C19H33NO4
IUPAC Name 7-[(2s)-2-[(e,3r)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]heptanoic acid
Molecular Mass 339.470 g·mol−1
Heat of Formation -962.5 ± 16.7 kJ·mol−1
Dipole Moment 3.00 ± 1.08 D
Volume 463.91 Å 3
Surface Area 379.11 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 0.44 ± eV
Point Group Symmetry C1
Synonyms
  • 1-pyrrolidineheptanoic acid, 2-(3-hydroxy-1-octenyl)-5-oxo-, (r*,s*-(e))-(+-)-
  • 11-deoxy-8-azaprostaglandin e(1)
  • 7-[(2s)-2-[(e,3r)-3-hydroxyoct-1-enyl]-5-keto-pyrrolidin-1-yl]enanthic acid
  • 7-[(2s)-2-[(e,3r)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]heptanoic acid
  • 7-[(2s)-2-[(e,3r)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]heptanoic acid
  • 7-[(2s)-2-[(e,3r)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]heptanoic acid
CAS Number(s)
  • 57740-61-1
InChIKey XOPMUDZOEKPBQZ-HZTRFMAJSA-N
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