(5Z,13E,15S)-1,15-Dihydroxyprosta-5,13-Dien-9-One

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Properties Simple | Detailed

Formula C20H34O3
IUPAC Name (2r,3r)-2-[(z)-7-hydroxyhept-2-enyl]-3-[(e,3s)-3-hydroxyoct-1-enyl]cyclopentanone
Molecular Mass 322.482 g·mol−1
Heat of Formation -696.4 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 456.71 Å 3
Surface Area 364.27 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 3.50 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r)-2-[(z)-7-hydroxyhept-2-enyl]-3-[(e,3s)-3-hydroxyoct-1-enyl]-1-cyclopentanone
  • (2r,3r)-2-[(z)-7-hydroxyhept-2-enyl]-3-[(e,3s)-3-hydroxyoct-1-enyl]cyclopentan-1-one
  • 11-deoxy-pge2-1-ol
  • 11-deoxyprostaglandin e2-1-alcohol
  • prosta-5,13-dien-9-one, 1,15-dihydroxy-, (5z,13e,15s)-
CAS Number(s)
  • 138898-70-1
InChIKey SEMCUKYPAAMRLU-MADZDOCKSA-N
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