BMFYB4DAs018
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|SysName=Itaconic acid | |SysName=Itaconic acid | ||
Latest revision as of 09:00, 1 October 2008
| 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 | 97-65-4 |
| KEGG | C00490 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMFYB4DAs018.mol |
| Itaconate | |
|---|---|
| |
| Structural Information | |
| Systematic Name | Itaconic acid |
| Common Name |
|
| Symbol | |
| Formula | C5H6O4 |
| Exact Mass | 130.0266 |
| Average Mass | 130.0987 |
| SMILES | C=C(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
- this ⇔ 4- [2- [3- [ [4- [ [ [(2R,3S,4R,5R) -5- (6-Aminopurin-9-yl) -4-hydroxy-3-phosphonooxyoxolan-2-yl] methoxy-hydroxyphosphoryl] oxy-hydroxyphosphoryl] oxy-2-hydroxy-3,3-dimethylbutanoyl] amino] propanoylamino] ethylsulfanyl] -2-methylidene-4-oxobutanoic acid
- cis-Prop-1-ene-1,2,3-tricarboxylic acid ⇔ this
