BMFYB4DAr019
From Metabolomics.JP
| 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 : BMFY Fatty acyl 脂肪酸 : BMFYB branched chain 分岐 (200 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 498-24-8 |
| KEGG | C01732 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMFYB4DAr019.mol |
| Mesaconate | |
|---|---|
| |
| Structural Information | |
| Systematic Name | Mesaconic acid |
| Common Name |
|
| Symbol | |
| Formula | C5H6O4 |
| Exact Mass | 130.0266 |
| Average Mass | 130.0987 |
| SMILES | CC(=CC(O)=O)C(O)=O |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
Related Atomic Mappings, Enzymes, and Pathways
