Record Information |
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Version | 5.0 |
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Status | Detected and Quantified |
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Creation Date | 2005-11-16 15:48:42 UTC |
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Update Date | 2023-02-21 17:14:53 UTC |
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HMDB ID | HMDB0000508 |
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Secondary Accession Numbers | |
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Metabolite Identification |
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Common Name | Ribitol |
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Description | Ribitol is a pentose alcohol formed by the reduction of ribose. It occurs naturally in plants as well as in the cell walls of some Gram-positive bacteria. Ribitol forms part of the chemical structure of riboflavin and flavin mononucleotide (FMN). It is also a metabolic end product formed by the reduction of ribose in human fibroblasts and erythrocytes. In this regard ribitol is found in all organisms from bacteria to plants to humans. Ribitol is a normal constituent of human urine (PMID: 2736321 ). Elevated levels of ribitol in the serum or urine can be found in patients with transaldolase deficiency (PMID: 11283793 ). Transaldolase is an important enzyme in the pentose phosphate pathway (PPP). Elevated levels of ribitol in the serum or urine can be found in patients with Ribose-5-phosphate isomerase deficiency (PMID: 14988808 ). Ribose-5-phosphate isomerase is an important enzyme in the pentose phosphate pathway (PPP). Export of ribitol across the cell membrane indicates that can be cleared from the body without metabolic conversion (PMID 15234337 ). Ribitol is normally absent in Breast milk (PMID 16456418 ). |
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Structure | OC[C@H](O)[C@H](O)[C@H](O)CO InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5- |
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Synonyms | Value | Source |
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(2R,3S,4S)-Pentane-1,2,3,4,5-pentol | ChEBI | Adonitol | ChEBI | D-Adonitol | ChEBI | D-Ribitol | ChEBI | L-Ribitol | ChEBI | 1,2,3,4,5-Pentanepentol | HMDB | Adonit | HMDB | Adonite | HMDB | Pentitol | HMDB |
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Chemical Formula | C5H12O5 |
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Average Molecular Weight | 152.1458 |
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Monoisotopic Molecular Weight | 152.068473494 |
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IUPAC Name | (2R,3s,4S)-pentane-1,2,3,4,5-pentol |
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Traditional Name | ribitol |
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CAS Registry Number | 488-81-3 |
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SMILES | OC[C@H](O)[C@H](O)[C@H](O)CO |
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InChI Identifier | InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5- |
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InChI Key | HEBKCHPVOIAQTA-ZXFHETKHSA-N |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as sugar alcohols. These are hydrogenated forms of carbohydrate in which the carbonyl group (aldehyde or ketone, reducing sugar) has been reduced to a primary or secondary hydroxyl 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 alcohols |
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Alternative Parents | |
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Substituents | - Sugar alcohol
- Monosaccharide
- Secondary alcohol
- Polyol
- Hydrocarbon derivative
- Primary alcohol
- Alcohol
- Aliphatic acyclic compound
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Molecular Framework | Aliphatic acyclic compounds |
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External Descriptors | |
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Ontology |
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Physiological effect | Not Available |
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Disposition | |
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Process | Not Available |
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Role | |
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Physical Properties |
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State | Solid |
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Experimental Molecular Properties | |
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Experimental Chromatographic Properties | Not Available |
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Predicted Molecular Properties | |
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Predicted Chromatographic Properties | Predicted Collision Cross SectionsPredicted Kovats Retention IndicesUnderivatizedDerivatizedDerivative Name / Structure | SMILES | Kovats RI Value | Column Type | Reference |
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Ribitol,1TMS,isomer #1 | C[Si](C)(C)OC[C@H](O)[C@H](O)[C@H](O)CO | 1545.5 | Semi standard non polar | 33892256 | Ribitol,1TMS,isomer #2 | C[Si](C)(C)O[C@@H](CO)[C@H](O)[C@H](O)CO | 1512.2 | Semi standard non polar | 33892256 | Ribitol,1TMS,isomer #3 | C[Si](C)(C)O[C@@H]([C@@H](O)CO)[C@H](O)CO | 1495.4 | Semi standard non polar | 33892256 | Ribitol,1TMS,isomer #4 | C[Si](C)(C)O[C@H](CO)[C@@H](O)[C@@H](O)CO | 1512.2 | Semi standard non polar | 33892256 | Ribitol,1TMS,isomer #5 | C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@@H](O)CO | 1545.5 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #1 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO | 1586.6 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #10 | C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@@H](O)CO | 1586.6 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #2 | C[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO | 1583.3 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #3 | C[Si](C)(C)OC[C@H](O)[C@H](O)[C@@H](CO)O[Si](C)(C)C | 1606.5 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #4 | C[Si](C)(C)OC[C@H](O)[C@H](O)[C@H](O)CO[Si](C)(C)C | 1611.0 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #5 | C[Si](C)(C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H](O)CO | 1560.0 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #6 | C[Si](C)(C)O[C@@H](CO)[C@H](O)[C@@H](CO)O[Si](C)(C)C | 1579.4 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #7 | C[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](CO)O[Si](C)(C)C | 1606.5 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #8 | C[Si](C)(C)O[C@@H]([C@@H](O)CO)[C@@H](CO)O[Si](C)(C)C | 1560.0 | Semi standard non polar | 33892256 | Ribitol,2TMS,isomer #9 | C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@@H](O)CO | 1583.3 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #1 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO | 1633.1 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #10 | C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](O)CO | 1633.1 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #2 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C | 1647.8 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #3 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C | 1664.4 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #4 | C[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C | 1643.4 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #5 | C[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C | 1657.8 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #6 | C[Si](C)(C)OC[C@H](O)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C | 1664.4 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #7 | C[Si](C)(C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C | 1621.9 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #8 | C[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C)[C@H](CO)O[Si](C)(C)C | 1643.4 | Semi standard non polar | 33892256 | Ribitol,3TMS,isomer #9 | C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O)[C@H](CO)O[Si](C)(C)C | 1647.8 | Semi standard non polar | 33892256 | Ribitol,4TMS,isomer #1 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO)O[Si](C)(C)C | 1661.8 | Semi standard non polar | 33892256 | Ribitol,4TMS,isomer #2 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)CO[Si](C)(C)C | 1681.2 | Semi standard non polar | 33892256 | Ribitol,4TMS,isomer #3 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C | 1695.2 | Semi standard non polar | 33892256 | Ribitol,4TMS,isomer #4 | C[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C | 1681.2 | Semi standard non polar | 33892256 | Ribitol,4TMS,isomer #5 | C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](CO)O[Si](C)(C)C | 1661.8 | Semi standard non polar | 33892256 | Ribitol,5TMS,isomer #1 | C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C | 1737.8 | Semi standard non polar | 33892256 | Ribitol,1TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O)[C@H](O)CO | 1798.2 | Semi standard non polar | 33892256 | Ribitol,1TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)O[C@@H](CO)[C@H](O)[C@H](O)CO | 1752.5 | Semi standard non polar | 33892256 | Ribitol,1TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)O[C@@H]([C@@H](O)CO)[C@H](O)CO | 1741.0 | Semi standard non polar | 33892256 | Ribitol,1TBDMS,isomer #4 | CC(C)(C)[Si](C)(C)O[C@H](CO)[C@@H](O)[C@@H](O)CO | 1752.5 | Semi standard non polar | 33892256 | Ribitol,1TBDMS,isomer #5 | CC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@@H](O)CO | 1798.2 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)CO | 2023.2 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #10 | CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H](O)CO | 2023.2 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)CO | 2031.8 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O)[C@@H](CO)O[Si](C)(C)C(C)(C)C | 2041.0 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #4 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C | 2046.5 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #5 | CC(C)(C)[Si](C)(C)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)CO | 2032.2 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #6 | CC(C)(C)[Si](C)(C)O[C@@H](CO)[C@H](O)[C@@H](CO)O[Si](C)(C)C(C)(C)C | 2024.2 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #7 | CC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](CO)O[Si](C)(C)C(C)(C)C | 2041.0 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #8 | CC(C)(C)[Si](C)(C)O[C@@H]([C@@H](O)CO)[C@@H](CO)O[Si](C)(C)C(C)(C)C | 2032.2 | Semi standard non polar | 33892256 | Ribitol,2TBDMS,isomer #9 | CC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)CO | 2031.8 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)CO | 2304.3 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #10 | CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)CO | 2304.3 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H](CO)O[Si](C)(C)C(C)(C)C | 2313.8 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C | 2304.0 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #4 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO)O[Si](C)(C)C(C)(C)C | 2330.8 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #5 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)CO[Si](C)(C)C(C)(C)C | 2339.9 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #6 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O)[C@@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | 2304.0 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #7 | CC(C)(C)[Si](C)(C)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO)O[Si](C)(C)C(C)(C)C | 2330.1 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #8 | CC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](CO)O[Si](C)(C)C(C)(C)C | 2330.8 | Semi standard non polar | 33892256 | Ribitol,3TBDMS,isomer #9 | CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](CO)O[Si](C)(C)C(C)(C)C | 2313.8 | Semi standard non polar | 33892256 | Ribitol,4TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO)O[Si](C)(C)C(C)(C)C | 2542.6 | Semi standard non polar | 33892256 | Ribitol,4TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)CO[Si](C)(C)C(C)(C)C | 2546.4 | Semi standard non polar | 33892256 | Ribitol,4TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | 2537.1 | Semi standard non polar | 33892256 | Ribitol,4TBDMS,isomer #4 | CC(C)(C)[Si](C)(C)OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | 2546.4 | Semi standard non polar | 33892256 | Ribitol,4TBDMS,isomer #5 | CC(C)(C)[Si](C)(C)OC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](CO)O[Si](C)(C)C(C)(C)C | 2542.6 | Semi standard non polar | 33892256 | Ribitol,5TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | 2763.6 | Semi standard non polar | 33892256 |
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Spectra |
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| GC-MS SpectraSpectrum Type | Description | Splash Key | Deposition Date | Source | View |
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Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (5 TMS) | splash10-0fr2-0930000000-5a1a8471040df361537c | 2014-06-16 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (Non-derivatized) | splash10-0gba-0940000000-39c5ee90545f38856669 | 2014-06-16 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (5 TMS) | splash10-00di-8941000000-a1eac40beaba679b545b | 2014-06-16 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (5 TMS) | splash10-00di-8930000000-85527d43cd5f10f959a8 | 2014-06-16 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-MS (5 TMS) | splash10-0gb9-0962000000-9c177252fb79fd04ff8c | 2014-06-16 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Non-derivatized) | splash10-0fr2-0930000000-5a1a8471040df361537c | 2017-09-12 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Non-derivatized) | splash10-0gba-0940000000-39c5ee90545f38856669 | 2017-09-12 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Non-derivatized) | splash10-00di-8941000000-a1eac40beaba679b545b | 2017-09-12 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-EI-TOF (Non-derivatized) | splash10-00di-8930000000-85527d43cd5f10f959a8 | 2017-09-12 | HMDB team, MONA, MassBank | View Spectrum | Experimental GC-MS | GC-MS Spectrum - Ribitol GC-MS (Non-derivatized) | splash10-0gb9-0962000000-9c177252fb79fd04ff8c | 2017-09-12 | HMDB team, MONA, MassBank | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (Non-derivatized) - 70eV, Positive | splash10-03dl-9100000000-738016d8bd07caed9ccc | 2017-09-01 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (5 TMS) - 70eV, Positive | splash10-0a4i-6033900000-a5ac27dc62580d112ccd | 2017-10-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (Non-derivatized) - 70eV, Positive | Not Available | 2021-10-12 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (Non-derivatized) - 70eV, Positive | Not Available | 2021-10-12 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_1_1) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_1_2) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_1_3) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_1_4) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_1_5) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_2_1) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_2_2) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_2_3) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_2_4) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_2_5) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - Ribitol GC-MS (TMS_2_6) - 70eV, Positive | Not Available | 2021-11-05 | Wishart Lab | View Spectrum |
MS/MS SpectraSpectrum Type | Description | Splash Key | Deposition Date | Source | View |
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Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol Quattro_QQQ 10V, Positive-QTOF (Annotated) | splash10-00kb-9200000000-1c9444c33ee213e4aa4f | 2012-07-24 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol Quattro_QQQ 25V, Positive-QTOF (Annotated) | splash10-05mo-9000000000-baf46067df2ebf3b854c | 2012-07-24 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol Quattro_QQQ 40V, Positive-QTOF (Annotated) | splash10-0006-9000000000-3276d3005611fd3d415c | 2012-07-24 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-0udi-0901000000-7db5e452cb762f33fd3a | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-014j-8900000000-5ee7c2252ae88c5c0198 | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-001i-0900000000-47c7512c4671bb121a01 | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-001i-1900000000-b984613919de5add093c | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-0ufr-0901000000-616311fa40559ac618da | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-014j-7900000000-c947bd6b615b2019d255 | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-000i-0900000000-c7e6bce3675a8cd1566b | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT (LTQ Orbitrap XL, Thermo Scientfic) , Positive-QTOF | splash10-0a4i-0900000000-419f37e184ec82e4c123 | 2012-08-31 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT , positive-QTOF | splash10-014j-8900000000-e69cc8758936cd2cbcea | 2017-09-14 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT , positive-QTOF | splash10-001i-0900000000-d6447ee4c80f85c44fef | 2017-09-14 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT , positive-QTOF | splash10-001i-1900000000-67203d89ca337c3cd9d1 | 2017-09-14 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT , positive-QTOF | splash10-014j-7900000000-867bbfc363a4790dadc1 | 2017-09-14 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT , positive-QTOF | splash10-000i-0900000000-c7e6bce3675a8cd1566b | 2017-09-14 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - Ribitol LC-ESI-ITFT , positive-QTOF | splash10-0a4i-0900000000-419f37e184ec82e4c123 | 2017-09-14 | HMDB team, MONA | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 10V, Positive-QTOF | splash10-0udi-1900000000-fd63152f503ab1d4aa19 | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 20V, Positive-QTOF | splash10-03di-9300000000-d230735907e604c9d45a | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 40V, Positive-QTOF | splash10-03dl-9000000000-91a543c0d92a8d8d3c3d | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 10V, Negative-QTOF | splash10-0udu-9300000000-e06ed1bf8e262afac25a | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 20V, Negative-QTOF | splash10-0btl-9100000000-b459e90a751cabc2a231 | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 40V, Negative-QTOF | splash10-0btc-9000000000-4943c8a982ad5101e46f | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 10V, Negative-QTOF | splash10-0zmr-9500000000-1887747b16d168b09609 | 2021-09-21 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - Ribitol 20V, Negative-QTOF | splash10-0a4i-9000000000-83f8fb1c321a951b0e7e | 2021-09-21 | Wishart Lab | View Spectrum |
NMR SpectraSpectrum Type | Description | Deposition Date | Source | View |
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Predicted 1D NMR | 1H NMR Spectrum (1D, 100 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 100 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 200 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 200 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 300 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 300 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 400 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 400 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 500 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 500 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 600 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 600 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 700 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 700 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 800 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 800 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 900 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 900 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Predicted 1D NMR | 13C NMR Spectrum (1D, 1000 MHz, D2O, predicted) | 2021-09-16 | Wishart Lab | View Spectrum | Experimental 1D NMR | 1H NMR Spectrum (1D, 500 MHz, H2O, experimental) | 2021-10-10 | Wishart Lab | View Spectrum | Experimental 2D NMR | [1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental) | 2012-12-05 | Wishart Lab | View Spectrum |
IR SpectraSpectrum Type | Description | Deposition Date | Source | View |
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Predicted IR Spectrum | IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M-H]-) | 2023-02-03 | FELIX lab | View Spectrum | Predicted IR Spectrum | IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+H]+) | 2023-02-03 | FELIX lab | View Spectrum | Predicted IR Spectrum | IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+Na]+) | 2023-02-03 | FELIX lab | View Spectrum |
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Biological Properties |
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Cellular Locations | |
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Biospecimen Locations | - Blood
- Cerebrospinal Fluid (CSF)
- Feces
- Urine
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Tissue Locations | |
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Pathways | |
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Normal Concentrations |
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Blood | Detected and Quantified | 2.5 (0.0 - 5.0) uM | Children (1-13 years old) | Both | Normal | | details | Blood | Detected and Quantified | 0.54 +/- 0.078 uM | Elderly (>65 years old) | Both | Normal | | details | Blood | Detected and Quantified | 0.460 (0.375-0.546) uM | Adult (>18 years old) | Both | Normal | | details | Cerebrospinal Fluid (CSF) | Detected and Quantified | 3.73 (3.01-4.45) uM | Adult (>18 years old) | Both | Normal | | details | Cerebrospinal Fluid (CSF) | Detected and Quantified | 17.8 (0.0-35.6) uM | Adult (>18 years old) | Both | Normal | | details | Cerebrospinal Fluid (CSF) | Detected and Quantified | 5.0 (0.0-10.0) uM | Adult (>18 years old) | Not Specified | Normal | | details | Cerebrospinal Fluid (CSF) | Detected and Quantified | 3.64 +/- 0.67 uM | Elderly (>65 years old) | Both | Normal | | details | Feces | Detected but not Quantified | Not Quantified | Infant (0-1 year old) | Both | Normal | | details | Feces | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Normal | | details | Feces | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Normal | | details | Feces | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Normal | | details | Urine | Detected and Quantified | 8.0 (5.0 - 11.0) umol/mmol creatinine | Children (1-13 years old) | Not Specified | Normal | | details | Urine | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Normal | | details | Urine | Detected and Quantified | 3.533 +/- 2.267 umol/mmol creatinine | Not Specified | Not Specified | Normal | | details | Urine | Detected and Quantified | 3.5 +/- 2.24 umol/mmol creatinine | Adult (>18 years old) | Both | Normal | | details |
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Abnormal Concentrations |
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Blood | Detected and Quantified | 0.55 +/- 0.08 uM | Elderly (>65 years old) | Both | Alzheimer's disease | | details | Blood | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Colorectal cancer | | details | Blood | Detected and Quantified | 20.0 (6.0–35.0) uM | Adult (>18 years old) | Both | Ribose-5-phosphate isomerase deficiency | | details | Cerebrospinal Fluid (CSF) | Detected and Quantified | 3.8 +/- 0.68 uM | Elderly (>65 years old) | Both | Alzheimer's disease | | details | Feces | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Colorectal Cancer | | details | Feces | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Colorectal cancer | | details | Urine | Detected and Quantified | 154.5 (123.0-186.0) umol/mmol creatinine | Newborn (0-30 days old) | Not Specified | Ribose-5-phosphate isomerase deficiency | | details | Urine | Detected but not Quantified | Not Quantified | Adult (>18 years old) | Both | Bladder cancer | | details |
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Associated Disorders and Diseases |
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Disease References | Alzheimer's disease |
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- Shetty HU, Holloway HW, Schapiro MB: Cerebrospinal fluid and plasma distribution of myo-inositol and other polyols in Alzheimer disease. Clin Chem. 1996 Feb;42(2):298-302. [PubMed:8595727 ]
| Colorectal cancer |
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- Ni Y, Xie G, Jia W: Metabonomics of human colorectal cancer: new approaches for early diagnosis and biomarker discovery. J Proteome Res. 2014 Sep 5;13(9):3857-70. doi: 10.1021/pr500443c. Epub 2014 Aug 14. [PubMed:25105552 ]
- Brown DG, Rao S, Weir TL, O'Malia J, Bazan M, Brown RJ, Ryan EP: Metabolomics and metabolic pathway networks from human colorectal cancers, adjacent mucosa, and stool. Cancer Metab. 2016 Jun 6;4:11. doi: 10.1186/s40170-016-0151-y. eCollection 2016. [PubMed:27275383 ]
- Goedert JJ, Sampson JN, Moore SC, Xiao Q, Xiong X, Hayes RB, Ahn J, Shi J, Sinha R: Fecal metabolomics: assay performance and association with colorectal cancer. Carcinogenesis. 2014 Sep;35(9):2089-96. doi: 10.1093/carcin/bgu131. Epub 2014 Jul 18. [PubMed:25037050 ]
| Ribose-5-phosphate isomerase deficiency |
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- Huck JH, Verhoeven NM, Struys EA, Salomons GS, Jakobs C, van der Knaap MS: Ribose-5-phosphate isomerase deficiency: new inborn error in the pentose phosphate pathway associated with a slowly progressive leukoencephalopathy. Am J Hum Genet. 2004 Apr;74(4):745-51. Epub 2004 Feb 25. [PubMed:14988808 ]
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Associated OMIM IDs | - 104300 (Alzheimer's disease)
- 114500 (Colorectal cancer)
- 608611 (Ribose-5-phosphate isomerase deficiency)
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External Links |
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DrugBank ID | Not Available |
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Phenol Explorer Compound ID | Not Available |
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FooDB ID | FDB022083 |
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KNApSAcK ID | C00001171 |
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Chemspider ID | 10254628 |
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KEGG Compound ID | C00474 |
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BioCyc ID | RIBITOL |
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BiGG ID | 35086 |
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Wikipedia Link | Ribitol |
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METLIN ID | 316 |
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PubChem Compound | Not Available |
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PDB ID | Not Available |
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ChEBI ID | 15963 |
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Food Biomarker Ontology | Not Available |
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VMH ID | RBT |
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MarkerDB ID | MDB00000177 |
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Good Scents ID | rw1216341 |
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References |
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Synthesis Reference | Yamazaki, Masayoshi; Yamazaki, Fumito; Muranaka, Chikako; Kozeki, Satomi; Tatsuno, Yoshiaki; Okamoto, Naoki. Manufacture of ribitol with Trichosporonoides. Jpn. Kokai Tokkyo Koho (1999), 6 pp. |
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Material Safety Data Sheet (MSDS) | Download (PDF) |
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General References | - Verhoeven NM, Huck JH, Roos B, Struys EA, Salomons GS, Douwes AC, van der Knaap MS, Jakobs C: Transaldolase deficiency: liver cirrhosis associated with a new inborn error in the pentose phosphate pathway. Am J Hum Genet. 2001 May;68(5):1086-92. Epub 2001 Mar 27. [PubMed:11283793 ]
- Huck JH, Verhoeven NM, Struys EA, Salomons GS, Jakobs C, van der Knaap MS: Ribose-5-phosphate isomerase deficiency: new inborn error in the pentose phosphate pathway associated with a slowly progressive leukoencephalopathy. Am J Hum Genet. 2004 Apr;74(4):745-51. Epub 2004 Feb 25. [PubMed:14988808 ]
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- Roboz J, Kappatos DC, Greaves J, Holland JF: Determination of polyols in serum by selected ion monitoring. Clin Chem. 1984 Oct;30(10):1611-5. [PubMed:6434200 ]
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- Wamelink MM, Smith DE, Jakobs C, Verhoeven NM: Analysis of polyols in urine by liquid chromatography-tandem mass spectrometry: a useful tool for recognition of inborn errors affecting polyol metabolism. J Inherit Metab Dis. 2005;28(6):951-63. [PubMed:16435188 ]
- Huck JH, Roos B, Jakobs C, van der Knaap MS, Verhoeven NM: Evaluation of pentitol metabolism in mammalian tissues provides new insight into disorders of human sugar metabolism. Mol Genet Metab. 2004 Jul;82(3):231-7. [PubMed:15234337 ]
- Georgescu C, Boboc F, Dumitrescu MR, Potcoava R, Florescu PD, Racovita D: [Identification of some atypical (morpho-cultural and enzymatic) characteristics of E. coli strains isolated in different clinical and epidemiological conditions]. Rev Ig Bacteriol Virusol Parazitol Epidemiol Pneumoftiziol Bacteriol Virusol Parazitol Epidemiol. 1980 Jan-Mar;25(1):17-26. [PubMed:6990452 ]
- Malnick H: Anaerobiospirillum thomasii sp. nov., an anaerobic spiral bacterium isolated from the feces of cats and dogs and from diarrheal feces of humans, and emendation of the genus Anaerobiospirillum. Int J Syst Bacteriol. 1997 Apr;47(2):381-4. [PubMed:9103625 ]
- De Baere T, Wauters G, Kampfer P, Labit C, Claeys G, Verschraegen G, Vaneechoutte M: Isolation of Buttiauxella gaviniae from a spinal cord patient with urinary bladder pathology. J Clin Microbiol. 2002 Oct;40(10):3867-70. [PubMed:12354904 ]
- Brenner DJ, Davis BR, Steigerwalt AG, Riddle CF, McWhorter AC, Allen SD, Farmer JJ 3rd, Saitoh Y, Fanning GR: Atypical biogroups of Escherichia coli found in clinical specimens and description of Escherichia hermannii sp. nov. J Clin Microbiol. 1982 Apr;15(4):703-13. [PubMed:7040466 ]
- Herzog C, Wood HC, Noel I, Booth JC: Comparison of a new enzyme-linked immunosorbent assay method with counterimmunoelectrophoresis for detection of teichoic acid antibodies in sera from patients with Staphylococcus aureus infections. J Clin Microbiol. 1984 Apr;19(4):511-5. [PubMed:6715518 ]
- Hickman-Brenner FW, Vohra MP, Huntley-Carter GP, Fanning GR, Lowery VA 3rd, Brenner DJ, Farmer JJ 3rd: Leminorella, a new genus of Enterobacteriaceae: identification of Leminorella grimontii sp. nov. and Leminorella richardii sp. nov. found in clinical specimens. J Clin Microbiol. 1985 Feb;21(2):234-9. [PubMed:3972991 ]
- Hickman-Brenner FW, Fanning GR, Arduino MJ, Brenner DJ, Farmer JJ 3rd: Aeromonas schubertii, a new mannitol-negative species found in human clinical specimens. J Clin Microbiol. 1988 Aug;26(8):1561-4. [PubMed:3139706 ]
- Konishi K, Yamagishi T, Sakamoto K: A Halophilic vibrio isolated from a case of chronic cholecystitis. Microbiol Immunol. 1981;25(12):1221-8. [PubMed:7334940 ]
- Brenner DJ, McWhorter AC, Kai A, Steigerwalt AG, Farmer JJ 3rd: Enterobacter asburiae sp. nov., a new species found in clinical specimens, and reassignment of Erwinia dissolvens and Erwinia nimipressuralis to the genus Enterobacter as Enterobacter dissolvens comb. nov. and Enterobacter nimipressuralis comb. nov. J Clin Microbiol. 1986 Jun;23(6):1114-20. [PubMed:3711302 ]
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- McWhorter AC, Haddock RL, Nocon FA, Steigerwalt AG, Brenner DJ, Aleksic S, Bockemuhl J, Farmer JJ 3rd: Trabulsiella guamensis, a new genus and species of the family Enterobacteriaceae that resembles Salmonella subgroups 4 and 5. J Clin Microbiol. 1991 Jul;29(7):1480-5. [PubMed:1885744 ]
- Podschun R: Phenotypic properties of Klebsiella pneumoniae and K. oxytoca isolated from different sources. Zentralbl Hyg Umweltmed. 1990 May;189(6):527-35. [PubMed:2200423 ]
- Yoshioka S, Kameyama K, Sanaka M, Sekine I, Kagimoto S, Fujitsuka S, Saitoh S: Effect of diabetes on the free polyol pattern in cataractous lenses. Clin Chem. 1991 May;37(5):686-9. [PubMed:2032321 ]
- Hudson MJ, Hollis DG, Weaver RE, Galvis CG: Relationship of CDC group EO-2 and psychrobacter immobilis. J Clin Microbiol. 1987 Oct;25(10):1907-10. [PubMed:3667912 ]
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- Roboz J, Kappatos DC, Holland JF: Role of individual serum pentitol concentrations in the diagnosis of disseminated visceral candidiasis. Eur J Clin Microbiol. 1987 Dec;6(6):708-14. [PubMed:3440465 ]
- Thaller MC, Berlutti F, Dainelli B, Pezzi R: New plate medium for screening and presumptive identification of gram-negative urinary tract pathogens. J Clin Microbiol. 1988 Apr;26(4):791-3. [PubMed:3366875 ]
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- Haga H, Nakajima T: Determination of polyol profiles in human urine by capillary gas chromatography. Biomed Chromatogr. 1989 Mar;3(2):68-71. doi: 10.1002/bmc.1130030206. [PubMed:2736321 ]
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