LBF17000BC02
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|LipidBank=DFA0239 | |LipidBank=DFA0239 | ||
Latest revision as of 09:00, 1 October 2008
Upper classes
| IDs and Links | |
|---|---|
| LipidBank | DFA0239 |
| LipidMaps | LMFA01020014 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | LBF17000BC02.mol |
| Isostearic acid | |
|---|---|
| |
| Structural Information | |
| Systematic Name | (+) -16-Methylheptadecanoic acid |
| Common Name |
|
| Symbol | |
| Formula | C18H36O2 |
| Exact Mass | 284.271530396 |
| Average Mass | 284.47724 |
| SMILES | CC(C)CCCCCCCCCCCCCCC(O)=O |
| Physicochemical Information | |
| Melting Point | 69.5°C |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | soluble in acetone , ether , petroleum ether.<<0179>><<6070>><<6009>> |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | Isopropyl : Doublet in 1360-1380cm-1 |
| NMR Spectra | |
| Chromatograms | |
