| Identification |
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| YMDB ID | YMDB01538 |
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| Name | Pimelylcarnitine |
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| Species | Saccharomyces cerevisiae |
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| Strain | Brewer's yeast |
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| Description | Pimelylcarnitine belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups. Pimelylcarnitine is an extremely weak basic (essentially neutral) compound (based on its pKa). |
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| Structure | |
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| Synonyms | - Heptanedioylcarnitine
- Pimelyl-L-carnitine
- (4S)-4-[(6-Carboxyhexanoyl)oxy]-4-(trimethylazaniumyl)butanoic acid
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| CAS number | Not Available |
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| Weight | Average: 303.3514
Monoisotopic: 303.168187537 |
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| InChI Key | AUWRHMAICBSXMC-NSHDSACASA-N |
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| InChI | InChI=1S/C14H25NO6/c1-15(2,3)11(9-10-13(18)19)21-14(20)8-6-4-5-7-12(16)17/h11H,4-10H2,1-3H3,(H-,16,17,18,19)/t11-/m0/s1 |
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| IUPAC Name | (4S)-4-[(6-carboxyhexanoyl)oxy]-4-(trimethylazaniumyl)butanoate |
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| Traditional IUPAC Name | (4S)-4-[(6-carboxyhexanoyl)oxy]-4-(trimethylammonio)butanoate |
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| Chemical Formula | C14H25NO6 |
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| SMILES | C[N+](C)(C)[C@H](CCC([O-])=O)OC(=O)CCCCCC(O)=O |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups. |
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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 | Tricarboxylic acids and derivatives |
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| Direct Parent | Tricarboxylic acids and derivatives |
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| Alternative Parents | |
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| Substituents | - Tricarboxylic acid or derivatives
- Fatty acid ester
- Fatty acyl
- Tetraalkylammonium salt
- Carboxylic acid salt
- Carboxylic acid ester
- Carboxylic acid
- Hydrocarbon derivative
- Organopnictogen compound
- Organic salt
- Organic oxygen compound
- Organooxygen compound
- Organonitrogen compound
- Organic nitrogen compound
- Carbonyl group
- Organic oxide
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | Not Available |
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| Physical Properties |
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| State | Solid |
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| Charge | 0 |
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| Melting point | Not Available |
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| Experimental Properties | | Property | Value | Reference |
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| Water Solubility | Not Available | PhysProp | | LogP | Not Available | PhysProp |
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| Predicted Properties | |
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| Biological Properties |
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| Cellular Locations | Not Available |
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| Organoleptic Properties | Not Available |
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| SMPDB Pathways | Not Available |
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| KEGG Pathways | Not Available |
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| SMPDB Reactions | Not Available |
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| KEGG Reactions | Not Available |
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| Concentrations |
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| Intracellular Concentrations | | Intracellular Concentration | Substrate | Growth Conditions | Strain | Citation |
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| 1 ± 0 µM | YEB media with 0.5 mM glucose | aerobic | Brewer's yeast | Experimentally Determined
Not Available | | Conversion Details Here |
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| Extracellular Concentrations | Not Available |
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| Spectra |
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| Spectra | |
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| References |
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| References: | Not Available |
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| Synthesis Reference: | Not Available |
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| External Links: | | Resource | Link |
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| CHEBI ID | Not Available | | HMDB ID | HMDB13328 | | Pubchem Compound ID | 53481675 | | Kegg ID | Not Available | | ChemSpider ID | Not Available | | FOODB ID | FDB029388 | | Wikipedia ID | Not Available | | BioCyc ID | Not Available |
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