(5Z,9β,11Alpha,13E,15S)-9,11,15-Trihydroxyprosta-5,13-Dien-1-Oic Acid

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Properties Simple | Detailed

Formula C20H34O5
IUPAC Name (z)-7-[(1r,2r,3r,5r)-3,5-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid
Molecular Mass 354.481 g·mol−1
Heat of Formation -1117.0 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 471.62 Å 3
Surface Area 360.8 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy 0.88 ± eV
Point Group Symmetry C1
Synonyms
  • (5z,13e,15s)-9beta,11alpha,15-trihydroxyprosta-5,13-dien-1-oic acid
  • (z)-7-[(1r,2r,3r,5r)-3,5-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid
  • 5-heptenoic acid, 7-[3,5-dihydroxy-2(3-hydroxy-1-octenyl)cyclopentyl]-, stereoisomer
  • 5-heptenoic acid,7-[3,5-dihydroxy-2(3-hydroxy-1-octenyl)cyclopentyl]-, stereoisomer
  • 9beta,11alpha-pgf2a
  • 9beta,11alpha-pgf2alpha
  • 9r,11r,15s-trihydroxy-5z,13e-prostadienoic acid
  • lmfa03010025
  • pdsp1_000079
  • pgf2b
  • pgf2beta
  • prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-,(5z,9beta,11alpha,13e,15s)-
  • prosta-5,13-dien-1-oic acid,9,11,15-trihydroxy-,(5z,9beta,11alpha,13e,15s)-
  • prostaglandin f2b
  • prostaglandin f2beta
CAS Number(s)
  • 4510-16-1
InChIKey PXGPLTODNUVGFL-JZFBHDEDSA-N
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