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

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Properties Simple | Detailed

Formula C20H30O4
IUPAC Name (z)-7-[2-[(e,3s)-3-hydroxyoct-1-enyl]-5-oxo-cyclopenten-1-yl]hept-5-enoic acid
Molecular Mass 334.450 g·mol−1
Heat of Formation -806.7 ± 16.7 kJ·mol−1
Dipole Moment 4.08 ± 1.08 D
Volume 454.03 Å 3
Surface Area 349.29 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[2-[(e,3s)-3-hydroxyoct-1-enyl]-5-keto-1-cyclopentenyl]hept-5-enoic acid
  • (z)-7-[2-[(e,3s)-3-hydroxyoct-1-enyl]-5-oxo-1-cyclopentenyl]hept-5-enoic acid
  • 15s-hydroxy-9-oxo-5z,8(12),13e-prostatrienoic acid
  • bcbcmap01_000173
  • lmfa03010018
  • pgb2
  • prosta-5,8(12),13-trien-1-oic acid, 15-hydroxy-9-oxo-, (5z,13e,15s)-
  • prostaglandin b2
CAS Number(s)
  • 13367-85-6
  • 28548-75-6
InChIKey PRFXRIUZNKLRHM-HKVRTXJWSA-N
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