| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 23:20:18 UTC |
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| Update Date | 2020-05-21 16:27:13 UTC |
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| BMDB ID | BMDB0006202 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | 4,8 dimethylnonanoyl carnitine |
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| Description | 4,8 Dimethylnonanoyl carnitine belongs to the class of organic compounds known as acyl carnitines. These are organic compounds containing a fatty acid with the carboxylic acid attached to carnitine through an ester bond. Thus, 4,8 dimethylnonanoyl carnitine is considered to be a fatty ester lipid molecule. 4,8 Dimethylnonanoyl carnitine is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. 4,8 Dimethylnonanoyl carnitine participates in a number of enzymatic reactions, within cattle. In particular, 4,8 Dimethylnonanoyl carnitine can be biosynthesized from 4,8-dimethylnonanoyl-CoA and L-carnitine; which is mediated by the enzyme carnitine O-palmitoyltransferase 2, mitochondrial. In addition, 4,8 Dimethylnonanoyl carnitine can be converted into 4,8 dimethylnonanoyl carnitine; which is catalyzed by the enzyme peroxisomal membrane protein. In cattle, 4,8 dimethylnonanoyl carnitine is involved in the metabolic pathway called the oxidation OF branched-chain fatty acids pathway. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 4,8-Dimethylnonanoylcarnitine | ChEBI |
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| Chemical Formula | C18H35NO4 |
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| Average Molecular Weight | 329.4748 |
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| Monoisotopic Molecular Weight | 329.256608613 |
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| IUPAC Name | 3-[(4,8-dimethylnonanoyl)oxy]-4-(trimethylazaniumyl)butanoate |
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| Traditional Name | 4,8-dimethylnonanoylcarnitine |
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| CAS Registry Number | Not Available |
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| SMILES | CC(C)CCCC(C)CCC(=O)OC(CC([O-])=O)C[N+](C)(C)C |
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| InChI Identifier | InChI=1S/C18H35NO4/c1-14(2)8-7-9-15(3)10-11-18(22)23-16(12-17(20)21)13-19(4,5)6/h14-16H,7-13H2,1-6H3 |
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| InChI Key | DDTDJDZHDFMZED-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as acyl carnitines. These are organic compounds containing a fatty acid with the carboxylic acid attached to carnitine through an ester bond. |
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| Kingdom | Organic compounds |
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| Super Class | Lipids and lipid-like molecules |
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| Class | Fatty Acyls |
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| Sub Class | Fatty acid esters |
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| Direct Parent | Acyl carnitines |
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| Alternative Parents | |
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| Substituents | - Acyl-carnitine
- Branched fatty acid
- Dicarboxylic acid or derivatives
- Tetraalkylammonium salt
- Quaternary ammonium salt
- Carboxylic acid ester
- Carboxylic acid salt
- Carboxylic acid derivative
- Carboxylic acid
- Organonitrogen compound
- Hydrocarbon derivative
- Organic oxide
- Organopnictogen compound
- Organic nitrogen compound
- Carbonyl group
- Organic oxygen compound
- Amine
- Organooxygen compound
- Organic salt
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Expected but not Quantified |
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| Origin | |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | - Cell membrane
- Cytoplasm
- Membrane
- Mitochondria
- Peroxisome
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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