9-{(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(1E,3S)-3-Hydroxy-4-Oxo-1-Octen-1-Yl]Cyclopentyl}Nonanoic Acid
Properties
Property | Value |
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Formula | C22H38O6 |
IUPAC Name | 9-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3s)-3-hydroxy-4-oxo-oct-1-enyl]cyclopentyl]nonanoic acid |
Molecular Mass | 398.534 g·mol−1 |
Heat of Formation | -1372.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.50 ± 1.08 D |
Volume | 535.13 Å 3 |
Surface Area | 462.97 Å 2 |
HOMO Energy | -9.93 ± 0.55 eV |
LUMO Energy | 0.21 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | UXNNRPQQYVIVOT-MHRRTSLBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |