(5Z,8B,11A,13E,15S)-11,15-Dihydroxy-9-Oxo-Prosta-5,13-Dien-1-Oic Acid

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Properties Simple | Detailed

Formula C20H32O5
IUPAC Name (z)-7-[(1s,2r,3r)-3-hydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
Molecular Mass 352.465 g·mol−1
Heat of Formation -1052.3 ± 16.7 kJ·mol−1
Dipole Moment 0.90 ± 1.08 D
Volume 475.15 Å 3
Surface Area 376.13 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy 0.55 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(1s,2r,3r)-3-hydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-5-keto-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1s,2r,3r)-3-hydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1s,2r,3r)-3-hydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
  • 8-iso-pge2
  • 8-isoprostaglandin e2
  • 9-oxo-11r,15s-dihydroxy-5z,13e-prostadienoic acid-cyclo[8s,12r]
  • lmfa03110003
  • prosta-5,13-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, (5z,8beta,11alpha,13e,15s)-
CAS Number(s)
  • 27415-25-4
InChIKey XEYBRNLFEZDVAW-CLQOMRTCSA-N
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