(5Z,11α,13E,15R)-11,15,19-Trihydroxy-16,16-Dimethyl-9-Oxoprosta-5,13-Dien-1-Oic Acid

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Properties Simple | Detailed

Formula C22H36O6
IUPAC Name (e)-7-[(1r,2r,3r)-2-[(e,3r,7s)-3,7-dihydroxy-4,4-dimethyl-oct-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]hept-5-enoic acid
Molecular Mass 396.518 g·mol−1
Heat of Formation -1292.7 ± 16.7 kJ·mol−1
Dipole Moment 3.59 ± 1.08 D
Volume 524.69 Å 3
Surface Area 385.3 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy 0.68 ± eV
Point Group Symmetry C1
InChIKey OXILDJLSALAFGQ-MSOQXPEYSA-N
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Elements H C O