BMMCACXXo005
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|SysName=Iridotrial | |SysName=Iridotrial | ||
| − | |Common Name=&& | + | |Common Name=&&Iridotrial&& |
|CAS=69098-42-6 | |CAS=69098-42-6 | ||
|KEGG=D00102 | |KEGG=D00102 | ||
}} | }} | ||
Latest revision as of 23:36, 3 February 2009
| Basic Metabolism Top (代謝トップ) |
Molecule Index (化合物索引) |
EC classes ( EC分類) |
Input New Data (新規入力) |
Upper classes : BM Basic Metabolites : BMMC mono- or assembled cycle 単、複合環 : BMMCAC aliphatic cycle 脂肪族環 (47 pages) : BMMCACXX others その他 (4 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 69098-42-6 |
| KEGG | D00102 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMMCACXXo005.mol |
| Iridotrial | |
|---|---|
| |
| Structural Information | |
| Systematic Name | Iridotrial |
| Common Name |
|
| Symbol | |
| Formula | C10H14O3 |
| Exact Mass | 182.0942 |
| Average Mass | 182.2163 |
| SMILES | O=CC(C=O)[C@@H](C1)[C@H](C=O)[C@@H](C)C1 |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
