(5Z,8β,11Alpha,12Alpha,13E,15S)-11,15-Dihydroxy-9-Oxoprosta-5,13-Dien-1-Oic Acid

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Properties Simple | Detailed

Formula C20H32O5
IUPAC Name (z)-7-[(1s,2s,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 -1055.1 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 463.04 Å 3
Surface Area 387.38 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy 0.71 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(1s,2s,3r)-3-hydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-5-keto-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1s,2s,3r)-3-hydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1s,2s,3r)-3-hydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
  • 8,12-epi-pge2
  • 8,12-epi-prostaglandin e2
  • prosta-5,13-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, (5z,8beta,11alpha,12alpha,13e,15s)-
CAS Number(s)
  • 39265-67-3
InChIKey XEYBRNLFEZDVAW-BSBCLDFQSA-N
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