(13E)-9-Oxoprost-13-En-1-Oic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C20H34O3
IUPAC Name 7-[(1r,2r)-2-[(e)-oct-1-enyl]-5-oxo-cyclopentyl]heptanoic acid
Molecular Mass 322.482 g·mol−1
Heat of Formation -803.2 ± 16.7 kJ·mol−1
Dipole Moment 3.48 ± 1.08 D
Volume 452.29 Å 3
Surface Area 417.3 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy 0.82 ± eV
Point Group Symmetry C1
Synonyms
  • 11,15-bisdeoxy-pge1
  • 11,15-bisdeoxyprostaglandin e1
  • 7-[(1r,2r)-2-[(e)-oct-1-enyl]-5-oxo-cyclopentyl]heptanoic acid
  • 7-[(1r,2r)-2-[(e)-oct-1-enyl]-5-oxocyclopentyl]heptanoic acid
  • 7-[(1r,5r)-2-keto-5-[(e)-oct-1-enyl]cyclopentyl]enanthic acid
  • 9-oxo-13-prostenoic acid
  • prost-13-en-1-oic acid, 9-oxo-, (13e)-
  • prost-13-en-1-oic acid, 9-oxo-, (13e)-(+-)-
CAS Number(s)
  • 40098-50-8
  • 41302-01-6
InChIKey NCJHQUGTCXBXNW-HZOVXUMNSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O