LBF20307PG08
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|LipidBank=XPR1411 | |LipidBank=XPR1411 | ||
Latest revision as of 09:00, 1 October 2008
Upper classes
| IDs and Links | |
|---|---|
| LipidBank | XPR1411 |
| LipidMaps | LMFA03010030 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | LBF20307PG08.mol |
| 15-KETOPROSTAGLANDIN E2 | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 7- [ 3 (R) -Hydroxy-2 (R) - (3-oxo-1 (E) -octenyl) -5-oxocyclopentan-1 (R) -yl ] -5 (Z) -heptenoic acid |
| Common Name |
|
| Symbol | |
| Formula | C20H30O5 |
| Exact Mass | 350.20932407 |
| Average Mass | 350.4492 |
| SMILES | C(CCC(=O)C=C[C@H]([C@H]1CC=CCCCC(O)=O)[C@@H](CC1=O |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | DIMETHOXIME TMS ETHER METHYL ESTER ; m/z 494(M+), 479, 463, 404, 373, 321, 180 <<1055>> |
| UV Spectra | METHYL ESTER ; l MeOHmax = 227nm (e ˜ 9000) <<1055>> |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
