(5Z)-7-{(1S,2S,3S,4R)-3-[(1E,3S)-3-Cyclohexyl-3-Hydroxy-1-Propen-1-Yl]-7-Oxabicyclo[2.2.1]Hept-2-Yl}-5-Heptenoic Acid

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Properties Simple | Detailed

Formula C22H34O4
IUPAC Name (z)-7-[(1s,2s,3s,4r)-3-[(e,3s)-3-cyclohexyl-3-hydroxy-prop-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid
Molecular Mass 362.503 g·mol−1
Heat of Formation -865.1 ± 16.7 kJ·mol−1
Dipole Moment 2.39 ± 1.08 D
Volume 471.76 Å 3
Surface Area 376.32 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy 3.71 ± eV
Point Group Symmetry C1
InChIKey CEHGUSRXHYTTPN-ZSMXBAJYSA-N
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