|
Record Information |
|---|
| Version |
1.0 |
|---|
| Update Date |
1/22/2018 11:54:54 AM |
|---|
|
Metabolite ID | PAMDB120128 |
|---|
|
Identification |
|---|
| Name: |
4-acetamidobutanoate |
|---|
| Description: | A monocarboxylic acid anion that is the conjugate base of 4-acetamidobutanoic acid, arising from deprotonation of the carboxy group. |
|---|
|
Structure |
|
|---|
| Synonyms: | - 4-acetamidobutanoate
- N-acetyl-4-aminobutyrate
- N-acetyl-γ-aminobutyrate
- N4-Acetylaminobutanoate
|
|---|
|
Chemical Formula: |
C6H10NO3 |
|---|
| Average Molecular Weight: |
144.15 |
|---|
| Monoisotopic Molecular
Weight: |
145.0739 |
|---|
| InChI Key: |
UZTFMUBKZQVKLK-UHFFFAOYSA-M |
|---|
| 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 |
|---|
| CAS
number: |
3025-96-5 |
|---|
| IUPAC Name: | 4-acetamidobutanoate |
|---|
|
Traditional IUPAC Name: |
4-acetamidobutyrate |
|---|
| SMILES: | CC(=O)NCCCC(=O)[O-] |
|---|
|
Chemical Taxonomy |
|---|
|
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. |
|---|
|
Kingdom |
Chemical entities |
|---|
| Super Class | Organic compounds |
|---|
|
Class |
Organic acids and derivatives |
|---|
| Sub Class | Carboxylic acids and derivatives |
|---|
|
Direct Parent |
Gamma amino acids and derivatives |
|---|
| Alternative Parents |
|
|---|
| 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
|
|---|
| Molecular Framework |
Aliphatic acyclic compounds |
|---|
| External Descriptors |
|
|---|
|
Physical Properties |
|---|
| State: |
Solid |
|---|
| Charge: | -1 |
|---|
|
Melting point: |
Not Available |
|---|
| Experimental Properties: |
| Property | Value | Reference |
|---|
| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
|
|---|
| Predicted Properties |
|
|---|
|
Biological Properties |
|---|
| Cellular Locations: |
Not Available |
|---|
| Reactions: | |
|---|
|
Pathways: |
|
|---|
|
Spectra |
|---|
| Spectra: |
|
|---|
|
References |
|---|
| References: |
- Seiler N, Al-Therib MJ (1974)Putrescine catabolism in mammalian brain. The Biochemical journal 144, Pubmed: 4156831
|
|---|
| Synthesis Reference: |
Not Available |
|---|
| Material Safety Data Sheet (MSDS) |
Download (PDF) |
|---|
|
Links |
|---|
| External Links: |
|
|---|
