(5Z,13E,15S,19R)-15,19-Dihydroxy-9-Oxoprosta-5,8(12),13-Trien-1-Oic Acid

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Properties Simple | Detailed

Formula C20H30O5
IUPAC Name (z)-7-[2-[(e,3s,7r)-3,7-dihydroxyoct-1-enyl]-5-oxo-cyclopenten-1-yl]hept-5-enoic acid
Molecular Mass 350.449 g·mol−1
Heat of Formation -1014.0 ± 16.7 kJ·mol−1
Dipole Moment 5.10 ± 1.08 D
Volume 451.06 Å 3
Surface Area 358.85 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[2-[(e,3s,7r)-3,7-dihydroxyoct-1-enyl]-5-keto-1-cyclopentenyl]hept-5-enoic acid
  • (z)-7-[2-[(e,3s,7r)-3,7-dihydroxyoct-1-enyl]-5-oxo-1-cyclopentenyl]hept-5-enoic acid
  • 19(r)-hydroxy-pgb2
  • 9-oxo-15s,19r-dihydroxy-5z,8(12),13e-prostatrienoic acid
  • lmfa03010167
InChIKey PPYRMVKHPFIXEU-NIDWPLIZSA-N
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