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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 12:54:54 PM |
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Metabolite ID | PAMDB120128 |
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Identification |
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| Name: |
4-acetamidobutanoate |
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| Description: | A monocarboxylic acid anion that is the conjugate base of 4-acetamidobutanoic acid, arising from deprotonation of the carboxy group. |
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Structure |
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| Synonyms: | - 4-acetamidobutanoate
- N-acetyl-4-aminobutyrate
- N-acetyl-γ-aminobutyrate
- N4-Acetylaminobutanoate
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Chemical Formula: |
C6H10NO3 |
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| Average Molecular Weight: |
144.15 |
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| Monoisotopic Molecular
Weight: |
145.0739 |
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| InChI Key: |
UZTFMUBKZQVKLK-UHFFFAOYSA-M |
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| InChI: | InChI=1S/C6H11NO3/c1-5(8)7-4-2-3-6(9)10/h2-4H2,1H3,(H,7,8)(H,9,10)/p-1 |
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| CAS
number: |
3025-96-5 |
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| IUPAC Name: | 4-acetamidobutanoate |
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Traditional IUPAC Name: |
4-acetamidobutyrate |
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| SMILES: | CC(=O)NCCCC(=O)[O-] |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of chemical entities known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom. |
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Kingdom |
Chemical entities |
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| Super Class | Organic compounds |
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Class |
Organic acids and derivatives |
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| Sub Class | Carboxylic acids and derivatives |
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Direct Parent |
Gamma amino acids and derivatives |
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| Alternative Parents |
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| Substituents |
- Gamma amino acid or derivatives
- Straight chain fatty acid
- Fatty acid
- Fatty acyl
- Carboximidic acid
- Organic 1,3-dipolar compound
- Propargyl-type 1,3-dipolar organic compound
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboximidic acid derivative
- Hydrocarbon derivative
- Carbonyl group
- Organooxygen compound
- Organonitrogen compound
- Organic nitrogen compound
- Organic oxide
- Organopnictogen compound
- Organic oxygen compound
- Aliphatic acyclic compound
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| Molecular Framework |
Aliphatic acyclic compounds |
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| External Descriptors |
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Physical Properties |
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| State: |
Solid |
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| Charge: | -1 |
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Melting point: |
Not Available |
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| Experimental Properties: |
| Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties |
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Biological Properties |
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| Cellular Locations: |
Not Available |
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| Reactions: | |
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Pathways: |
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Spectra |
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| Spectra: |
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References |
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| References: |
- Seiler N, Al-Therib MJ (1974)Putrescine catabolism in mammalian brain. The Biochemical journal 144, Pubmed: 4156831
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| Synthesis Reference: |
Not Available |
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| Material Safety Data Sheet (MSDS) |
Download (PDF) |
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Links |
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| External Links: |
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