(5Z,9β,11Alpha,15S)-11,15-Dihydroxy-6,9-Epoxyprost-5-En-13-Yn-1-Oic Acid

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Properties Simple | Detailed

Formula C20H30O5
IUPAC Name (5z)-5-[(3ar,4s,5r,6as)-5-hydroxy-4-[(3s)-3-hydroxyoct-1-ynyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-ylidene]pentanoic acid
Molecular Mass 350.449 g·mol−1
Heat of Formation -903.7 ± 16.7 kJ·mol−1
Dipole Moment 1.81 ± 1.08 D
Volume 443.99 Å 3
Surface Area 381.18 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy 1.07 ± eV
Point Group Symmetry C1
InChIKey TTXYATZQSSMBRM-WJUPDCJKSA-N
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