(4E)-6-{(1S,3R,5S)-3,5-Dihydroxy-2-[(1E,5E,8E)-3-Hydroxy-1,5,8-Undecatrien-1-Yl]Cyclopentyl}-4-Hexenoic Acid

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Properties Simple | Detailed

Formula C22H34O5
IUPAC Name (z)-6-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(1e,3s,5e,8z)-3-hydroxyundeca-1,5,8-trienyl]cyclopentyl]hex-4-enoic acid
Molecular Mass 378.502 g·mol−1
Heat of Formation -973.4 ± 16.7 kJ·mol−1
Dipole Moment 1.92 ± 1.08 D
Volume 503.03 Å 3
Surface Area 385.87 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy 0.66 ± eV
Point Group Symmetry C1
InChIKey SNPJCMSWLFPGRU-IUOQPIOWSA-N
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