(5Z,11α,13E,15S)-11,15-Dimethoxy-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-methoxy-2-[(e,3s)-3-methoxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
Molecular Mass 380.518 g·mol−1
Heat of Formation -1034.2 ± 16.7 kJ·mol−1
Dipole Moment 3.07 ± 1.08 D
Volume 513.87 Å 3
Surface Area 392.99 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 0.74 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(1r,2r,3r)-3-methoxy-2-[(e,3s)-3-methoxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-3-methoxy-2-[(e,3s)-3-methoxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-5-keto-3-methoxy-2-[(e,3s)-3-methoxyoct-1-enyl]cyclopentyl]hept-5-enoic acid
  • ono-ae-248
InChIKey MXDQOCKVVLKVJS-QKIVIXBWSA-N
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