| Record Information |
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| Version | 1.0 |
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| Creation date | 2015-10-09 22:33:23 UTC |
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| Update date | 2017-01-19 02:36:41 UTC |
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| FoodComEx ID | PC000915 |
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| FoodDB Record | FDB023136 |
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| Chemical Information |
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| Name | Gulonic acid |
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| Description | Reduction product of glucuronic acid; oxidation product of l-gulose [HMDB] |
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| CAS Number | 20246-53-1 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| D-Gulonate | hmdb | | D-Gulonic acid | hmdb | | Gulonate | hmdb | | L-Gulonate | hmdb | | L-Gulonic acid | hmdb |
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| Chemical Formula | C6H12O7 |
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| IUPAC name | (2R,3R,4S,5R)-2,3,4,5,6-pentahydroxyhexanoic acid |
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| InChI Identifier | InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/t2-,3+,4-,5-/m1/s1 |
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| InChI Key | RGHNJXZEOKUKBD-KKQCNMDGSA-N |
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| Isomeric SMILES | OC[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)C(O)=O |
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| Average Molecular Weight | 196.1553 |
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| Monoisotopic Molecular Weight | 196.058302738 |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as medium-chain hydroxy acids and derivatives. These are hydroxy acids with a 6 to 12 carbon atoms long side chain. |
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| Kingdom | Organic compounds |
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| Super Class | Organic acids and derivatives |
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| Class | Hydroxy acids and derivatives |
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| Sub Class | Medium-chain hydroxy acids and derivatives |
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| Direct Parent | Medium-chain hydroxy acids and derivatives |
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| Alternative Parents | |
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| Substituents | - Medium-chain hydroxy acid
- Medium-chain fatty acid
- Beta-hydroxy acid
- Hydroxy fatty acid
- Alpha-hydroxy acid
- Monosaccharide
- Fatty acyl
- Fatty acid
- Secondary alcohol
- Polyol
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Organooxygen compound
- Hydrocarbon derivative
- Organic oxide
- Carbonyl group
- Primary alcohol
- Alcohol
- Organic oxygen compound
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | Not Available |
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| Physico-Chemical Properties - Experimental |
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| Property | Value | Reference |
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| Experimental logP | Not Available | |
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| Experimental Water Solubility | Not Available | |
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| Melting Point | Not Available | |
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| Foods of Origin |
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| Food | Content Range | Average | Reference |
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| Food | | | Reference |
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| Production Data |
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| Production Method | commercial |
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| Production Method Reference | Not Available |
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| Production Method Reference File | Not Available |
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| Quantity Available | Production upon request, up to 2 g |
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| Delivery Time | Not Available |
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| Storage Form | solid |
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| Storage Conditions | -80°C |
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| Stability | Not Available |
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| Purity | Not Available |
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| Spectra |
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| Spectral Data Upon Request | Not Available |
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| Provider Information |
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| Commercial Vendors |
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| Not Available |
