Record Information |
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Version | 1.0 |
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Creation date | 2015-10-09 22:27:57 UTC |
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Update date | 2017-01-19 02:36:11 UTC |
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FoodComEx ID | PC000070 |
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FoodDB Record | FDB012485 |
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Chemical Information |
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Name | Nicotinamide |
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Description | Niacinamide, also known as nicotinamid or nicovit, belongs to the class of organic compounds known as nicotinamides. These are heterocyclic aromatic compounds containing a pyridine ring substituted at position 3 by a carboxamide group. Niacinamide is a strong basic compound (based on its pKa). Niacinamide exists in all living species, ranging from bacteria to humans. niacinamide and phosphoribosyl pyrophosphate can be converted into nicotinic acid mononucleotide and phosphate through the action of the enzyme nicotinamide phosphoribosyltransferase. In humans, niacinamide is involved in the metabolic disorder called the nad+ signalling pathway (cancer). Niacinamide is an odorless tasting compound. Outside of the human body, Niacinamide is found, on average, in the highest concentration within a few different foods, such as common sages, milk (cow), and cocoa beans and in a lower concentration in common pea and beers. Niacinamide has also been detected, but not quantified in, several different foods, such as pineappple sages, boysenberries, cashew nuts, macadamia nut (m. tetraphylla), and sweet marjorams. This could make niacinamide a potential biomarker for the consumption of these foods. Niacinamide is a potentially toxic compound. A pyridinecarboxamide that is pyridine in which the hydrogen at position 3 is replaced by a carboxamide group. |
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CAS Number | 98-92-0 |
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Structure | |
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Synonyms | Synonym | Source |
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β-Pyridinecarboxamide | biospider | 3-(Aminocarbonyl)pyridine | biospider | 3-Amidopyridine | biospider | 3-Carbamoylpyridine | biospider | 3-Pyridinecarboxamide | biospider | 3-Pyridinecarboxylic acid amide | biospider | 6-Aminonicotinamide | biospider | Acid amide | HMDB | Amid kyseliny nikotinove | HMDB | Amide PP | biospider | Aminicotin | HMDB | Amixicotyn | HMDB | Amnicotin | HMDB | Austrovit PP | HMDB | b-Pyridinecarboxamide | biospider | Benicot | manual | beta-Pyridinecarboxamide | biospider | Delonin amide | manual | Dipegyl | HMDB | Dipigyl | HMDB | Endobion | HMDB | Factor PP | HMDB | Hansamid | HMDB | Inovitan PP | HMDB | m-(Aminocarbonyl)pyridine | biospider | Mediatric | HMDB | NAM | HMDB | Nandervit-N | HMDB | Niacevit | HMDB | Niacinamide | db_source | Niamide | HMDB | Niavit PP | HMDB | Nicamide | HMDB | Nicamina | HMDB | Nicamindon | HMDB | Nicasir | HMDB | Nicobion | HMDB | Nicofort | HMDB | Nicogen | HMDB | Nicomidol | HMDB | Nicosan 2 | HMDB | Nicosylamide | manual | Nicota | HMDB | Nicotamide | biospider | Nicotilamide | biospider | Nicotililamido | HMDB | Nicotinamid | ChEBI | Nicotinamida | HMDB | Nicotinamide | biospider | Nicotinamidum | HMDB | Nicotinate amide | Generator | Nicotine acid amide | biospider | Nicotine amide | biospider | Nicotinic acid amide | db_source | Nicotinic amide | biospider | Nicotinsaeureamid | ChEBI | Nicotinsaureamid | HMDB | Nicotol | HMDB | Nicotylamide | biospider | Nicotylamidum | HMDB | Nicovel | HMDB | Nicovit | HMDB | Nicovitina | HMDB | Nicovitol | HMDB | Nicozymin | HMDB | Nictoamide | HMDB | Niko-tamin | HMDB | Nikotinamid | ChEBI | Nikotinsaeureamid | ChEBI | Niocinamide | HMDB | Niozymin | HMDB | Papulex | HMDB | Pelmin | HMDB | Pelmine | HMDB | Pelonin amide | HMDB | PP-Faktor | HMDB | Pyridine-3-carboxylic acid amide | biospider | Savacotyl | HMDB | Vi-nicotyl | HMDB | Vi-noctyl | HMDB | Vitamin B3 (Nicotinamide) | biospider | Vitamin PP | ChEBI | Vitamin PP (Nicotinamide) | biospider | Witamina PP | HMDB | β-pyridinecarboxamide | Generator |
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Chemical Formula | C6H6N2O |
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IUPAC name | pyridine-3-carboxamide |
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InChI Identifier | InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9) |
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InChI Key | DFPAKSUCGFBDDF-UHFFFAOYSA-N |
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Isomeric SMILES | NC(=O)C1=CC=CN=C1 |
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Average Molecular Weight | 122.1246 |
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Monoisotopic Molecular Weight | 122.048012824 |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as nicotinamides. These are heterocyclic aromatic compounds containing a pyridine ring substituted at position 3 by a carboxamide group. |
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Kingdom | Organic compounds |
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Super Class | Organoheterocyclic compounds |
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Class | Pyridines and derivatives |
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Sub Class | Pyridinecarboxylic acids and derivatives |
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Direct Parent | Nicotinamides |
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Alternative Parents | |
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Substituents | - Nicotinamide
- Heteroaromatic compound
- Primary carboxylic acid amide
- Carboxamide group
- Azacycle
- Carboxylic acid derivative
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Organonitrogen compound
- Aromatic heteromonocyclic compound
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Molecular Framework | Aromatic heteromonocyclic compounds |
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External Descriptors | |
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Physico-Chemical Properties - Experimental |
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Property | Value | Reference |
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Experimental logP | -0.37 | HANSCH,C ET AL. (1995) |
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Experimental Water Solubility | 500 mg/mL at 25 oC | MERCK INDEX (1996) |
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Melting Point | Mp 129-130° | DFC |
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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 5 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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AKSci | 7652AF |
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AKSci | J10422 |
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AKSci | K774 |
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Cayman Chemical | 11127 |
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Glentham | GP9253 |
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ICN BioMedical | HMDB0001406 |
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MetaSci | HMDB0001406 |
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Toronto Research Chemicals | N407750 |
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