(5Z,11α,13E,15S)-11,15,20-Trihydroxy-9-Oxoprosta-5,13-Dien-1-Oic Acid

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Properties Simple | Detailed

Formula C20H32O6
IUPAC Name (z)-7-[(1r,2r,3r)-2-[(e,3s)-3,8-dihydroxyoct-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]hept-5-enoic acid
Molecular Mass 368.464 g·mol−1
Heat of Formation -1217.2 ± 16.7 kJ·mol−1
Dipole Moment 4.92 ± 1.08 D
Volume 488.01 Å 3
Surface Area 383.79 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy 0.63 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(1r,2r,3r)-2-[(e,3s)-3,8-dihydroxyoct-1-enyl]-3-hydroxy-5-keto-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-2-[(e,3s)-3,8-dihydroxyoct-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-2-[(e,3s)-3,8-dihydroxyoct-1-enyl]-3-hydroxy-5-oxocyclopentyl]hept-5-enoic acid
  • 20-hydroxy-pge2
  • 20-hydroxyprostaglandin e2
  • 9-oxo-11r,15s,20-trihydroxy-5z,13e-prostadienoic acid
  • prosta-5,13-dien-1-oic acid, 11,15,20-trihydroxy-9-oxo-, (5z,11alpha,13e,15s)-
CAS Number(s)
  • 57930-95-7
InChIKey AZIGEYVZEVXWAD-NZGURKHLSA-N
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