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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 12:54:54 PM |
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Metabolite ID | PAMDB110200 |
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Identification |
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| Name: |
2-dehydro-3-deoxy-D-gluconate 6-phosphate |
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| Description: | An organophosphate oxoanion that is a trianion arising from deprotonation of the carboxylic acid and phosphate groups of 2-dehydro-3-deoxy-6-phospho-D-gluconic acid. |
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Structure |
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| Synonyms: | -
2-keto-3-deoxy-6-phospho-D-gluconate
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2-dehydro-3-deoxy-6-phospho-D-gluconate
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2-keto-3-deoxy-6-phospho-gluconate
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6-phospho-2-dehydro-3-deoxy-D-gluconate
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2-keto-3-deoxy-6-phosphogluconate
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2-keto-3-deoxy-6-P-gluconate
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6-p-2-k-3-deo-gluconate
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6-phospho-2-keto-3-deoxygluconate
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6-phospho-2-dehydro-3-deoxygluconate
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2-keto-3-deoxygluconate-6-P
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3-deoxy-D-erythro-hex-2-ulosonic acid 6-phosphate
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3-deoxy-D-erythro-hex-2-ulosonate-6-phosphate
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Chemical Formula: |
C6H8O9P
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| Average Molecular Weight: |
255.1 |
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| Monoisotopic Molecular
Weight: |
258.014068462 |
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| InChI Key: |
OVPRPPOVAXRCED-WVZVXSGGSA-K |
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| InChI: |
InChI=1S/C6H11O9P/c7-3(1-4(8)6(10)11)5(9)2-15-16(12,13)14/h3,5,7,9H,1-2H2,(H,10,11)(H2,12,13,14)/p-3/t3-,5+/m0/s1 |
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| CAS
number: |
27244-54-8 |
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| IUPAC Name: | 3-deoxy-6-O-phosphonato-D-erythro-hex-2-ulosonate |
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Traditional IUPAC Name: |
kdpg intermediate |
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| SMILES: | C(=O)([O-])C(=O)CC(O)C(O)COP([O-])(=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 keto acids and derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain. |
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Kingdom |
Chemical entities |
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| Super Class | Organic compounds |
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Class |
Organic acids and derivatives |
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| Sub Class | 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
- Monoalkyl phosphate
- Alpha-keto acid
- Beta-hydroxy ketone
- Organic phosphoric acid derivative
- Phosphoric acid ester
- Alkyl phosphate
- Alpha-hydroxy ketone
- Ketone
- 1,2-diol
- Secondary alcohol
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Organooxygen compound
- Organic oxygen compound
- Carbonyl group
- Alcohol
- Organic oxide
- Hydrocarbon derivative
- 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: | -3 |
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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: |
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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: |
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