| Record Information |
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| Version | 1.0 |
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| Creation date | 2015-10-09 22:31:28 UTC |
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| Update date | 2017-01-19 02:36:29 UTC |
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| FoodComEx ID | PC000598 |
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| FoodDB Record | FDB022865 |
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| Chemical Information |
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| Name | N-Methyl-alpha-aminoisobutyric acid |
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| Description | N-Methyl-a-aminoisobutyric acid is a metabolite that is actively incorporated into the cell by the actions of Interleukin 1-beta and Interleukin 6 via sodium dependent transport systems (PMID 16202926) [HMDB] |
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| CAS Number | 2566-34-9 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| N-Methyl-a-aminoisobutyrate | hmdb | | N-Methyl-a-aminoisobutyric acid | hmdb | | N-Methyl-alpha-aminoisobutyrate | hmdb | | N-Methyl-alpha-aminoisobutyric acid | hmdb | | N-Methylaminoisobutyrate | Generator |
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| Chemical Formula | C5H11NO2 |
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| IUPAC name | 2-methyl-2-(methylamino)propanoic acid |
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| InChI Identifier | InChI=1S/C5H11NO2/c1-5(2,6-3)4(7)8/h6H,1-3H3,(H,7,8) |
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| InChI Key | DLAMVQGYEVKIRE-UHFFFAOYSA-N |
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| Isomeric SMILES | CNC(C)(C)C(O)=O |
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| Average Molecular Weight | 117.1463 |
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| Monoisotopic Molecular Weight | 117.078978601 |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). |
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| Kingdom | Organic compounds |
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| Super Class | Organic acids and derivatives |
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| Class | Carboxylic acids and derivatives |
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| Sub Class | Amino acids, peptides, and analogues |
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| Direct Parent | Alpha amino acids |
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| Alternative Parents | |
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| Substituents | - Alpha-amino acid
- Amino acid
- Carboxylic acid
- Secondary aliphatic amine
- Monocarboxylic acid or derivatives
- Secondary amine
- Organic nitrogen compound
- Hydrocarbon derivative
- Organooxygen compound
- Organonitrogen compound
- Organic oxide
- Organopnictogen compound
- Organic oxygen compound
- Carbonyl group
- Amine
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | Not Available |
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| Physico-Chemical Properties - Experimental |
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| Property | Value | Reference |
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| Experimental logP | Not Available | |
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| Experimental Water Solubility | Not Available | |
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| Melting Point | Not Available | |
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| Foods of Origin |
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| Food | Content Range | Average | Reference |
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| Food | | | Reference |
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| Production Data |
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| Production Method | commercial |
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| Production Method Reference | Not Available |
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| Production Method Reference File | Not Available |
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| Quantity Available | Production upon request, up to 200 mg |
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| Delivery Time | Not Available |
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| Storage Form | solid |
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| Storage Conditions | -80°C |
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| Stability | Not Available |
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| Purity | Not Available |
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| Spectra |
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| Spectral Data Upon Request | Not Available |
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| Provider Information |
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| Commercial Vendors |
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| AKSci | 5084AH |
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| AKSci | HTS033389 |
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