(2E,11α,13E,15R)-11,15-Dihydroxy-16,16-Dimethyl-9-Oxoprosta-2,13-Dien-1-Oic Acid

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Properties Simple | Detailed

Formula C22H36O5
IUPAC Name (e)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-oxo-cyclopentyl]hept-2-enoic acid
Molecular Mass 380.518 g·mol−1
Heat of Formation -1098.6 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 516.57 Å 3
Surface Area 414.26 Å 2
HOMO Energy -10.12 ± 0.55 eV
LUMO Energy -0.29 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-keto-cyclopentyl]hept-2-enoic acid
  • (e)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-oxo-cyclopentyl]hept-2-enoic acid
  • (e)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]hept-2-enoic acid
  • 16,16-dimethyl-delta(2)-pge1
  • 16,16-dimethyl-delta2-prostaglandin e1
  • 16,16-dm-pge1
  • pg ono 802
  • prosta-2,13-dien-1-oic acid, 11,15-dihydroxy-16,16-dimethyl-9-oxo-, (2e,11alpha,13e,15r)-
CAS Number(s)
  • 64318-77-0
InChIKey QKSCEMRWJSJFCT-MAHJIVSJSA-N
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