(5Z,11α,13E,15R)-11,15-Dihydroxy-16,16-Dimethyl-9-Oxoprosta-5,13-Dien-1-Oic Acid

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Properties Simple | Detailed

Formula C22H36O5
IUPAC Name (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
Molecular Mass 380.518 g·mol−1
Heat of Formation -1152.0 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 502.98 Å 3
Surface Area 365.28 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy 0.63 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-keto-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
  • 16,16-dimethylprostaglandin- e2
  • 9-oxo-11r,15r-dihydroxy-16,16-dimethyl-5z,13e-prostadienoic acid
  • dipge2
  • dm-pge2
  • lmfa03010065
InChIKey QAOBBBBDJSWHMU-WMBBNPMCSA-N
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