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 | PAMDB110001 |
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Identification |
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Name: |
3-deoxy-D-manno-octulosonate 8-phosphate |
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Description: | A carbohydrate acid anion that is a trianion arising from deprotonation of the carboxy and phospho groups of 8-phospho-3-deoxy-D-manno-oct-2-ulosonic acid; major species at pH 7.3. |
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Structure |
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Synonyms: | -
3-deoxy-D-manno-octulosonate 8-P
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2-dehydro-3-deoxy-D-octonate 8-P
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2-dehydro-3-deoxy-D-octonate 8-phosphate
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Kdo-8P
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Chemical Formula: |
C8H12O11P
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Average Molecular Weight: |
315.15 |
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Monoisotopic Molecular
Weight: |
318.0351978346 |
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InChI Key: |
RTNBXJBOAIDPME-SHUUEZRQSA-K |
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InChI: |
InChI=1S/C8H15O11P/c9-3(1-4(10)8(14)15)6(12)7(13)5(11)2-19-20(16,17)18/h3,5-7,9,11-13H,1-2H2,(H,14,15)(H2,16,17,18)/p-3/t3-,5-,6-,7-/m1/s1 |
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CAS
number: |
Not Available |
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IUPAC Name: | 3-deoxy-8-O-phosphonato-D-manno-oct-2-ulosonate |
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Traditional IUPAC Name: |
Not Available |
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SMILES: | C(C(C(C(C(COP([O-])([O-])=O)O)O)O)O)C(=O)C([O-])=O |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of organic compounds known as monosaccharide phosphates. These are monosaccharides comprising a phosphated group linked to the carbohydrate unit. |
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Kingdom |
Organic compounds |
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Super Class | Organic oxygen compounds |
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Class |
Organooxygen compounds |
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Sub Class | Carbohydrates and carbohydrate conjugates |
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Direct Parent |
Monosaccharide phosphates |
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Alternative Parents |
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Substituents |
- Octose monosaccharide
- Monosaccharide phosphate
- Medium-chain keto acid
- Sugar acid
- Alpha-keto acid
- Beta-hydroxy ketone
- Keto acid
- Alkyl phosphate
- Phosphoric acid ester
- Organic phosphoric acid derivative
- Ketone
- Secondary alcohol
- Carboxylic acid
- Carboxylic acid derivative
- Monocarboxylic acid or derivatives
- Polyol
- Alcohol
- Carbonyl group
- Hydrocarbon derivative
- Organic oxide
- Organic anion
- Aliphatic acyclic compound
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Molecular Framework |
Aliphatic acyclic compounds |
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External Descriptors |
- a small molecule (KDO-8P)
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Physical Properties |
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State: |
Not Available |
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Charge: | -3 |
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Melting point: |
Not Available |
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Experimental Properties: |
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: |
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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