| Record Information |
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| Version | 1.0 |
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| Creation date | 2015-10-09 22:31:22 UTC |
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| Update date | 2017-01-19 02:36:28 UTC |
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| FoodComEx ID | PC000582 |
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| FoodDB Record | FDB023151 |
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| Chemical Information |
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| Name | 5-Aminopentanoic acid |
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| Description | 5-aminopentanoic acid is a normal metabolite present in human saliva, with a tendency to elevated concentration in patients with chronic periodontitis. Bacterial contamination and decomposition of salivary proteins is responsible for the elevated salivary levels (PMID 3481959) [HMDB] |
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| CAS Number | 660-88-8 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| 5-Aminopentanoate | hmdb | | 5-Aminopentanoic acid | hmdb | | 5-Aminovalerate | hmdb | | 5-Aminovaleric acid | hmdb | | delta-Amino-n-valerate | hmdb | | delta-Amino-n-valeric acid | hmdb | | delta-Aminovalerate | hmdb | | delta-Aminovaleric acid | hmdb |
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| Chemical Formula | C5H11NO2 |
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| IUPAC name | 5-aminopentanoic acid |
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| InChI Identifier | InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8) |
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| InChI Key | JJMDCOVWQOJGCB-UHFFFAOYSA-N |
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| Isomeric SMILES | NCCCCC(O)=O |
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| Average Molecular Weight | 117.1463 |
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| Monoisotopic Molecular Weight | 117.078978601 |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as delta amino acids and derivatives. Delta amino acids and derivatives are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom. |
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| Kingdom | Organic compounds |
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| Super Class | Organic acids and derivatives |
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| Class | Carboxylic acids and derivatives |
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| Sub Class | Amino acids, peptides, and analogues |
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| Direct Parent | Delta amino acids and derivatives |
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| Alternative Parents | |
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| Substituents | - Delta amino acid or derivatives
- Straight chain fatty acid
- Fatty acid
- Fatty acyl
- Amino acid
- Carboxylic acid
- Monocarboxylic acid or derivatives
- Amine
- Hydrocarbon derivative
- Organic oxide
- Primary amine
- Organooxygen compound
- Organonitrogen compound
- Organopnictogen compound
- Primary aliphatic amine
- Organic oxygen compound
- Organic nitrogen compound
- Carbonyl group
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic 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 | 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 300 mg |
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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 | J93715 |
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| AKSci | L796 |
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| MetaSci | HMDB0003355 |
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| Sigma-Aldrich | HMDB0003355 |
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| Toronto Research Chemicals | A632610 |
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