| Record Information |
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| Version | 1.0 |
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| Creation date | 2015-10-09 22:29:50 UTC |
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| Update date | 2017-01-19 02:36:19 UTC |
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| FoodComEx ID | PC000309 |
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| FoodDB Record | FDB022148 |
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| Chemical Information |
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| Name | Dodecanedioic acid |
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| Description | Dodecanedioic acid is a dicarboxylic acid which is water soluble and involves in a metabolic pathway intermediate to those of lipids and carbohydrates. (PMID 9591306). Dodecanedioid acid is an indicator of hepatic carnitine palmitoyltransferase I (CPT IA) deficiency. CPT IA deficiency is characterized by hypoketotic dicarboxylic aciduria with high urinary levels of dodecanedioic acid. This C12 dicarboxylic aciduria suggests that carnitine palmitoyltransferase I may play a role in the uptake of long-chain dicarboxylic acids by mitochondria after their initial shortening by beta-oxidation in peroxisomes. (PMID: 16146704) [HMDB] |
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| CAS Number | 693-23-2 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| 1,10-Decanedicarboxylate | hmdb | | 1,10-Decanedicarboxylic acid | hmdb | | 1,10-Dicarboxydecane | hmdb | | 1,12-Dodecanedioate | hmdb | | 1,12-Dodecanedioic acid | hmdb | | Corfree M 2 | hmdb | | Decamethylenedicarboxylate | hmdb | | Decamethylenedicarboxylic acid | hmdb | | Dodecanedioate | Generator | | n-Dodecane-a,w-dioate | hmdb | | n-Dodecane-a,w-dioic acid | hmdb | | n-Dodecanedioate | hmdb | | n-Dodecanedioic acid | hmdb | | SL-AH | hmdb |
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| Chemical Formula | C12H22O4 |
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| IUPAC name | dodecanedioic acid |
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| InChI Identifier | InChI=1S/C12H22O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h1-10H2,(H,13,14)(H,15,16) |
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| InChI Key | TVIDDXQYHWJXFK-UHFFFAOYSA-N |
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| Isomeric SMILES | OC(=O)CCCCCCCCCCC(O)=O |
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| Average Molecular Weight | 230.3007 |
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| Monoisotopic Molecular Weight | 230.151809192 |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms. |
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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 acids and conjugates |
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| Direct Parent | Medium-chain fatty acids |
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| Alternative Parents | |
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| Substituents | - Medium-chain fatty acid
- Dicarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Carbonyl group
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | |
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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 2 g |
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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 | R902 |
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| Toronto Research Chemicals | D494530 |
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