BMFYB4DAs012
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 | 49601-06-1 |
| KEGG | C02504 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMFYB4DAs012.mol |
| (2S) -2-Isopropylmalate | |
|---|---|
| |
| Structural Information | |
| Systematic Name | (2S) -2-Hydroxy-2-propan-2-ylbutanedioic acid |
| Common Name |
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| Symbol | |
| Formula | C7H12O5 |
| Exact Mass | 176.0684 |
| Average Mass | 176.1671 |
| SMILES | CC(C)C(O)(CC(O)=O)C(O)=O |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
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| NMR Spectra | |
| Chromatograms | |
Related Atomic Mappings, Enzymes, and Pathways
- this ⇔ 3-Methyl-2-oxo-butanoic acid
- this ⇔ (Z) -2-Propan-2-ylbut-2-enedioic acid
- this ⇔ S- [2- [3- [ [ (2R) -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] ethyl] ethanethioate
