Record Information |
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Version | 2.0 |
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Creation Date | 2015-09-08 17:50:01 -0600 |
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Update Date | 2015-09-08 17:50:01 -0600 |
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Secondary Accession Numbers | |
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Identification |
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Name: | 5-dehydro-4-deoxy-D-glucarate(2−) |
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Description | |
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Structure | |
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Synonyms: | - 5-dehydro-4-Deoxy-D-glucaric acid(2−)
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Chemical Formula: | C6H6O7 |
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Weight: | Average: 190.1076 Monoisotopic: 190.011352546 |
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InChI Key: | QUURPCHWPQNNGL-ZAFYKAAXSA-L |
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InChI: | InChI=1S/C6H8O7/c7-2(4(9)6(12)13)1-3(8)5(10)11/h2,4,7,9H,1H2,(H,10,11)(H,12,13)/p-2/t2-,4+/m0/s1 |
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CAS number: | Not Available |
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IUPAC Name: | (2R,3S)-2,3-dihydroxy-5-oxohexanedioate |
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Traditional IUPAC Name: | 5-dehydro-4-deoxy-D-glucarate |
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SMILES: | O[C@@H](CC(=O)C([O-])=O)[C@@H](O)C([O-])=O |
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Chemical Taxonomy |
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Description | belongs to the class of organic compounds known as medium-chain keto acids and derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain. |
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Kingdom | Organic compounds |
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Super Class | Organic acids and derivatives |
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Class | Keto acids and derivatives |
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Sub Class | Medium-chain keto acids and derivatives |
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Direct Parent | Medium-chain keto acids and derivatives |
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Alternative Parents | |
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Substituents | - Medium-chain keto acid
- Beta-hydroxy acid
- Alpha-keto acid
- Beta-hydroxy ketone
- Dicarboxylic acid or derivatives
- Hydroxy acid
- Monosaccharide
- Ketone
- 1,2-diol
- Secondary alcohol
- Carboxylic acid
- Carboxylic acid derivative
- Organic oxide
- Carbonyl group
- Alcohol
- Organic oxygen compound
- Organooxygen compound
- Hydrocarbon derivative
- Organic anion
- 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: | Not Available |
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Charge: | -2 |
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Melting point: | Not Available |
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Experimental Properties: | |
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Predicted Properties | |
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Biological Properties |
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Cellular Locations: | Cytoplasm |
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Reactions: | |
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SMPDB Pathways: | superpathway of D-glucarate and D-galactarate degradation | PW000795 | |
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KEGG Pathways: | Not Available |
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EcoCyc Pathways: | Not Available |
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Concentrations |
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| 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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Material Safety Data Sheet (MSDS) | Not Available |
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Links |
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External Links: | Resource | Link |
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CHEBI ID | 42819 | HMDB ID | Not Available | Pubchem Compound ID | 5288442 | Kegg ID | Not Available | ChemSpider ID | Not Available | Wikipedia ID | Not Available | BioCyc ID | Not Available |
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