| Record Information |
|---|
| Version | 1.0 |
|---|
| Creation Date | 2020-03-03 19:21:05 UTC |
|---|
| Update Date | 2020-04-22 15:54:56 UTC |
|---|
| BMDB ID | BMDB0063759 |
|---|
| Secondary Accession Numbers | |
|---|
| Metabolite Identification |
|---|
| Common Name | Alanylphenylalanine |
|---|
| Description | Alanylphenylalanine, also known as AF or L-ala-L-phe, belongs to the class of organic compounds known as peptides. Peptides are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another. Based on a literature review a significant number of articles have been published on Alanylphenylalanine. |
|---|
| Structure | |
|---|
| Synonyms | | Value | Source |
|---|
| AF | ChEBI | | L-Ala-L-phe | ChEBI | | Alanylphenylalanine, (beta-ala)-isomer | HMDB | | L-Alanyl-L-phenylalanine | HMDB | | Alanylphenylalanine, (DL-pheala)-isomer | HMDB | | a-F Dipeptide | HMDB | | AF dipeptide | HMDB | | Ala-phe | HMDB | | Alanine phenylalanine dipeptide | HMDB | | Alanine-phenylalanine dipeptide | HMDB | | Alanyl-phenylalanine | HMDB | | N-Alanylphenylalanine | HMDB | | N-L-Alanyl-L-phenylalanine | HMDB | | NSC 89630 | HMDB | | Alanylphenylalanine | ChEBI |
|
|---|
| Chemical Formula | C12H16N2O3 |
|---|
| Average Molecular Weight | 236.271 |
|---|
| Monoisotopic Molecular Weight | 236.116092383 |
|---|
| IUPAC Name | (2S)-2-[(2S)-2-aminopropanamido]-3-phenylpropanoic acid |
|---|
| Traditional Name | (2S)-2-[(2S)-2-aminopropanamido]-3-phenylpropanoic acid |
|---|
| CAS Registry Number | Not Available |
|---|
| SMILES | C[C@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O |
|---|
| InChI Identifier | InChI=1S/C12H16N2O3/c1-8(13)11(15)14-10(12(16)17)7-9-5-3-2-4-6-9/h2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17)/t8-,10-/m0/s1 |
|---|
| InChI Key | OMNVYXHOSHNURL-WPRPVWTQSA-N |
|---|
| Chemical Taxonomy |
|---|
| Description | belongs to the class of organic compounds known as peptides. Peptides are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another. |
|---|
| Kingdom | Organic compounds |
|---|
| Super Class | Organic acids and derivatives |
|---|
| Class | Carboxylic acids and derivatives |
|---|
| Sub Class | Amino acids, peptides, and analogues |
|---|
| Direct Parent | Peptides |
|---|
| Alternative Parents | |
|---|
| Substituents | - Alpha peptide
- Phenylalanine or derivatives
- N-acyl-alpha-amino acid
- N-acyl-alpha amino acid or derivatives
- 3-phenylpropanoic-acid
- Alpha-amino acid or derivatives
- Amphetamine or derivatives
- Monocyclic benzene moiety
- Benzenoid
- Amino acid or derivatives
- Amino acid
- Carboximidic acid
- Carboximidic acid derivative
- Carboxylic acid
- Monocarboxylic acid or derivatives
- Organic 1,3-dipolar compound
- Propargyl-type 1,3-dipolar organic compound
- Organopnictogen compound
- Primary aliphatic amine
- Organic oxygen compound
- Amine
- Organic nitrogen compound
- Carbonyl group
- Hydrocarbon derivative
- Organonitrogen compound
- Organooxygen compound
- Organic oxide
- Primary amine
- Aromatic homomonocyclic compound
|
|---|
| Molecular Framework | Aromatic homomonocyclic compounds |
|---|
| External Descriptors | |
|---|
| Ontology |
|---|
| Status | Expected but not Quantified |
|---|
| Origin | |
|---|
| Biofunction | Not Available |
|---|
| Application | Not Available |
|---|
| Cellular locations | Not Available |
|---|
| Physical Properties |
|---|
| State | 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 | |
|---|
| Spectra |
|---|
| Spectra | |
|---|
