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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 11:54:54 AM |
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Metabolite ID | PAMDB120073 |
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Identification |
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| Name: |
dihydrolipoate |
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| Description: | The conjugate base of dihydrolipoic acid. |
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Structure |
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| Synonyms: | - 6,8-bis-sulfanyloctanoate
- 6,8-dihydrothioctate
- 6,8-dimercaptooctanoate
- dihydro-α-lipoate
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Chemical Formula: |
C8H15O2S2 |
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| Average Molecular Weight: |
207.325 |
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| Monoisotopic Molecular
Weight: |
208.05917 |
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| InChI Key: |
IZFHEQBZOYJLPK-SSDOTTSWSA-M |
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| InChI: | InChI=1S/C8H16O2S2/c9-8(10)4-2-1-3-7(12)5-6-11/h7,11-12H,1-6H2,(H,9,10)/p-1/t7-/m1/s1 |
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| CAS
number: |
462-20-4 |
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| IUPAC Name: | 6,8-disulfanyloctanoate |
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Traditional IUPAC Name: |
dihydrolipoic acid |
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| SMILES: | C(S)CC(S)CCCCC(=O)[O-] |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of chemical entities 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 |
Chemical entities |
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| Super Class | Organic compounds |
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Class |
Lipids and lipid-like molecules |
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| Sub Class | Fatty Acyls |
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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
- Thia fatty acid
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Alkylthiol
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Organosulfur compound
- 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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Physical Properties |
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| State: |
Solid |
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| Charge: | -1 |
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Melting point: |
Not Available |
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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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Biological Properties |
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| Cellular Locations: |
Not Available |
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| Reactions: | |
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Pathways: |
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Spectra |
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| Spectra: |
Not Available |
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References |
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| References: |
- Prehn JH, Karkoutly C, Nuglisch J, Peruche B, Krieglstein J (1992)Dihydrolipoate reduces neuronal injury after cerebral ischemia. Journal of cerebral blood flow and metabolism : official journal of the International Society of Cerebral Blood Flow and Metabolism 12, Pubmed: 1345759
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| Synthesis Reference: |
Not Available |
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| Material Safety Data Sheet (MSDS) |
Not Available |
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Links |
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| External Links: |
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