|
Record Information |
|---|
| Version |
1.0 |
|---|
| Update Date |
1/22/2018 12:54:54 PM |
|---|
|
Metabolite ID | PAMDB120032 |
|---|
|
Identification |
|---|
| Name: |
4-guanidinobutyramide |
|---|
| Description: | A guanidinium ion arising from protonation of the imino NH of 4-guanidinobutanamide; major species at pH 7.3. |
|---|
|
Structure |
|
|---|
| Synonyms: | - 4-guanidiniumylbutanamide
- 4-guanidiniumylbutanamide cation
- 4-guanidinobutanamide
|
|---|
|
Chemical Formula: |
C5H13N4O |
|---|
| Average Molecular Weight: |
145.184 |
|---|
| Monoisotopic Molecular
Weight: |
145.10893 |
|---|
| InChI Key: |
YHVFECVVGNXFKO-UHFFFAOYSA-O |
|---|
| InChI: | InChI=1S/C5H12N4O/c6-4(10)2-1-3-9-5(7)8/h1-3H2,(H2,6,10)(H4,7,8,9)/p+1 |
|---|
| CAS
number: |
Not Available |
|---|
| IUPAC Name: | amino[(4-amino-4-oxobutyl)amino]methaniminium |
|---|
|
Traditional IUPAC Name: |
Not Available |
|---|
| SMILES: | C(NC(N)=[N+])CCC(=O)N |
|---|
|
Chemical Taxonomy |
|---|
|
Taxonomy Description | This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom. |
|---|
|
Kingdom |
Organic compounds |
|---|
| Super Class | Organic acids and derivatives |
|---|
|
Class |
Carboxylic acids and derivatives |
|---|
| Sub Class | Amino acids, peptides, and analogues |
|---|
|
Direct Parent |
Gamma amino acids and derivatives |
|---|
| Alternative Parents |
|
|---|
| Substituents |
- Gamma amino acid or derivatives
- Fatty acyl
- Fatty amide
- Primary carboxylic acid amide
- Carboxamide group
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Organonitrogen compound
- Carbonyl group
- Organic cation
- Aliphatic acyclic compound
|
|---|
| Molecular Framework |
Aliphatic acyclic compounds |
|---|
| External Descriptors |
- a small molecule (4-GUANIDO-BUTYRAMIDE)
|
|---|
|
Physical Properties |
|---|
| State: |
Not Available |
|---|
| Charge: | 1 |
|---|
|
Melting point: |
Not Available |
|---|
| Experimental Properties: |
Not Available |
|---|
| Predicted Properties |
|
|---|
|
Biological Properties |
|---|
| Cellular Locations: |
Not Available |
|---|
| Reactions: | |
|---|
|
Pathways: |
|
|---|
|
Spectra |
|---|
| Spectra: |
Not Available |
|---|
|
References |
|---|
| References: |
|
|---|
| Synthesis Reference: |
Not Available |
|---|
| Material Safety Data Sheet (MSDS) |
Not Available |
|---|
|
Links |
|---|
| External Links: |
|
|---|
