Methyl 6-({(1R,2S,3R)-2-[(1E)-5-Cyclohexyl-3-Hydroxy-1-Penten-1-Yl]-3-Hydroxy-5-Oxocyclopentyl}Sulfanyl)Hexanoate
Properties
Property | Value |
---|---|
Formula | C23H38O5S |
IUPAC Name | methyl 6-[(1r,2s,3r)-2-[(e,3s)-5-cyclohexyl-3-hydroxy-pent-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]sulfanylhexanoate |
Molecular Mass | 426.610 g·mol−1 |
Heat of Formation | -1125.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.98 ± 1.08 D |
Volume | 558.72 Å 3 |
Surface Area | 423.56 Å 2 |
HOMO Energy | -8.97 ± 0.55 eV |
LUMO Energy | -0.34 ± eV |
Point Group Symmetry | C1 |
InChIKey | HOMQOIVYFSPUGZ-OUDVCHGJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O |