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| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 23:04:28 UTC |
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| Update Date | 2020-06-04 20:32:38 UTC |
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| BMDB ID | BMDB0003418 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | D-Tagatose |
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| Description | D-Fructose, also known as D-tagatose or D-lyxo-2-hexulose, belongs to the class of organic compounds known as monosaccharides. Monosaccharides are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn. D-Fructose exists as a solid, possibly soluble (in water), and an extremely weak basic (essentially neutral) compound (based on its pKa) molecule. D-Fructose exists in all living species, ranging from bacteria to humans. D-Fructose participates in a number of enzymatic reactions, within cattle. In particular, D-Fructose can be biosynthesized from sorbitol through its interaction with the enzyme sorbitol dehydrogenase. In addition, D-Fructose can be biosynthesized from Beta-D-fructose 2-phosphate through the action of the enzyme 14 kda phosphohistidine phosphatase. In cattle, D-fructose is involved in the metabolic pathway called the fructose and mannose degradation pathway. D-Fructose is a potentially toxic compound. |
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| Structure | |
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| Synonyms | | Value | Source |
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| D-Lyxo-2-hexulose | HMDB | | D-Lyxo-hex-2-ulose | HMDB | | D-Tag | HMDB | | Lyxo-2-hexulose | HMDB | | Lyxo-hexulose | HMDB | | Tagatose | HMDB | | Tagatose, (D)-isomer | HMDB | | Tagatose, (beta-D)-isomer | HMDB | | Tagatose, (alpha-D)-isomer | HMDB | | Tagatose, (DL)-isomer | HMDB | | D-Tagatopyranose | HMDB | | Tagatopyranose | HMDB | | beta-D-Tagatopyranose | HMDB | | beta-D-Tagatose | HMDB | | Β-D-tagatopyranose | HMDB | | Β-D-tagatose | HMDB | | b-D-Tagatopyranose | HMDB | | D-Tagatose | HMDB |
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| Chemical Formula | C6H12O6 |
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| Average Molecular Weight | 180.156 |
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| Monoisotopic Molecular Weight | 180.063388106 |
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| IUPAC Name | Not Available |
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| Traditional Name | Not Available |
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| CAS Registry Number | 87-81-0 |
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| SMILES | Not Available |
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| InChI Identifier | InChI=1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4+,5+,6-/m1/s1 |
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| InChI Key | LKDRXBCSQODPBY-DPYQTVNSSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as monosaccharides. Monosaccharides are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn. |
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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 | Monosaccharides |
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| Alternative Parents | |
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| Substituents | - Oxane
- Monosaccharide
- Secondary alcohol
- Hemiacetal
- Oxacycle
- Organoheterocyclic compound
- Polyol
- Hydrocarbon derivative
- Primary alcohol
- Alcohol
- Aliphatic heteromonocyclic compound
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| Molecular Framework | Aliphatic heteromonocyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Detected and Quantified |
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| Origin | |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | Not Available |
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | 134.5 °C | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | -3.202 | Not Available |
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| Predicted Properties | Not Available |
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| Spectra |
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| Spectra | |
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| Biological Properties |
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| Cellular Locations | Not Available |
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| Biospecimen Locations | |
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| Pathways | |
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| Normal Concentrations |
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| Liver | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Liver | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 763.813 +/- 751.731 uM | Not Specified | Not Specified | Normal | | details |
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| Abnormal Concentrations |
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| Ruminal Fluid | Detected and Quantified | 2415.813 +/- 1248.434 uM | Not Specified | Not Specified | Rumen acidosis | | details |
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| External Links |
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| HMDB ID | HMDB0003418 |
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| DrugBank ID | Not Available |
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| Phenol Explorer Compound ID | Not Available |
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| FooDB ID | FDB001109 |
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| KNApSAcK ID | C00019683 |
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| Chemspider ID | 10194220 |
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| KEGG Compound ID | C00795 |
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| BioCyc ID | D-tagatose |
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| BiGG ID | Not Available |
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| Wikipedia Link | Tagatose |
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| METLIN ID | Not Available |
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| PubChem Compound | 14408225 |
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| PDB ID | Not Available |
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| ChEBI ID | 49092 |
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| References |
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| Synthesis Reference | Kim, Pil; Yoon, Sang Hyun; Seo, Myung Ji; Oh, Deok Kun; Choi, Jin Hwan. Improvement of tagatose conversion rate by genetic evolution of thermostable galactose isomerase. Biotechnology and Applied Biochemistry (2001), 34(2), 99-102. |
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| Material Safety Data Sheet (MSDS) | Not Available |
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| General References | Not Available |
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