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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 | PAMDB110002 |
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Identification |
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| Name: |
3-deoxy-D-manno-octulosonate |
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| Description: | Not Available |
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Structure |
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| Synonyms: | -
3-deoxy-D-manno-2-octulosonate
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3-deoxyoctulosonate
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3-Deoxy-D-mannooctulosonate
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3-Kdo
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3-Deoxyoctulosonic acid
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2-keto-3-deoxyoctonate
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deoxy-manno-octulosonate
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2-dehydro-3-deoxy-D-octonate
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Kdo
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ketodeoxyoctonate
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Chemical Formula: |
C8H13O8
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| Average Molecular Weight: |
237.19 |
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| Monoisotopic Molecular
Weight: |
238.0688674262 |
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| InChI Key: |
KYQCXUMVJGMDNG-SHUUEZRQSA-M |
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| InChI: |
InChI=1S/C8H14O8/c9-2-5(12)7(14)6(13)3(10)1-4(11)8(15)16/h3,5-7,9-10,12-14H,1-2H2,(H,15,16)/p-1/t3-,5-,6-,7-/m1/s1 |
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| CAS
number: |
Not Available |
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| IUPAC Name: | keto-3-deoxy-D-manno-oct-2-ulosonate |
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Traditional IUPAC Name: |
Not Available |
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| SMILES: | C(=O)([O-])C(=O)CC(O)C(O)C(O)C(O)CO |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of organic compounds known as sugar acids and derivatives. These are compounds containing a saccharide unit which bears a carboxylic acid group. |
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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 |
Sugar acids and derivatives |
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| Alternative Parents |
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| Substituents |
- Octose monosaccharide
- Medium-chain keto acid
- Sugar acid
- Alpha-keto acid
- Beta-hydroxy ketone
- Monosaccharide
- Keto acid
- 1,2-diol
- Secondary alcohol
- Ketone
- Carboxylic acid salt
- Carboxylic acid derivative
- Polyol
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Organic oxide
- Alcohol
- Primary alcohol
- Carbonyl group
- 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: | -1 |
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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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