| Common Name |
Prolyl-Valine
| Description |
Prolyl-Valine is a dipeptide composed of proline and valine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
| Structure |
MOLSDF3D-SDFPDBSMILESInChI View 3D Structure
Structure for HMDB29030 (Prolyl-Valine)
| Synonyms |
| Value |
Source |
L-Prolyl-L-valineHMDB
P-V DipeptideHMDB
pro-ValHMDB
Proline valine dipeptideHMDB
Proline-valine dipeptideHMDB
ProlylvalineHMDB
PV DipeptideHMDB
| Chemical Formlia |
C10H18N2O3
| Average Molecliar Weight |
214.2615
| Monoisotopic Molecliar Weight |
214.131742452
| IUPAC Name |
3-methyl-2-(pyrrolidin-2-ylformamido)butanoic acid
| Traditional Name |
3-methyl-2-(pyrrolidin-2-ylformamido)butanoic acid
| CAS Registry Number |
Not Available
| SMILES |
CC(C)C(NC(=O)C1CCCN1)C(O)=O
| InChI Identifier |
InChI=1S/C10H18N2O3/c1-6(2)8(10(14)15)12-9(13)7-4-3-5-11-7/h6-8,11H,3-5H2,1-2H3,(H,12,13)(H,14,15)
| InChI Key |
AWJGUZSYVIVZGP-UHFFFAOYSA-N
| Chemical Taxonomy |
| Description |
This compound belongs to the class of chemical entities known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
| Kingdom |
Chemical entities
| Super Class |
Organic compounds
| Class |
Organic acids and derivatives
| Sub Class |
Carboxylic acids and derivatives
| Direct Parent |
Dipeptides
| Alternative Parents |
Valine and derivatives
Proline and derivatives
N-acyl-alpha amino acids
Alpha amino acid amides
Pyrrolidinecarboxamides
Heterocyclic fatty acids
Methyl-branched fatty acids
Secondary carboxylic acid amides
Amino acids
Azacyclic compounds
Carboxylic acids
Dialkylamines
Monocarboxylic acids and derivatives
Organic oxides
Organopnictogen compounds
Carbonyl compounds
Hydrocarbon derivatives
| Substituents |
Alpha-dipeptide
Valine or derivatives
Proline or derivatives
N-acyl-alpha amino acid or derivatives
N-acyl-alpha-amino acid
Alpha-amino acid amide
Alpha-amino acid or derivatives
Pyrrolidine carboxylic acid or derivatives
Pyrrolidine-2-carboxamide
Branched fatty acid
Methyl-branched fatty acid
Heterocyclic fatty acid
Fatty acid
Fatty acyl
Pyrrolidine
Carboxamide group
Amino acid or derivatives
Secondary carboxylic acid amide
Amino acid
Carboxylic acid
Secondary aliphatic amine
Azacycle
Monocarboxylic acid or derivatives
Organoheterocyclic compound
Secondary amine
Organic nitrogen compound
Hydrocarbon derivative
Carbonyl group
Organic oxygen compound
Amine
Organopnictogen compound
Organic oxide
Organonitrogen compound
Organooxygen compound
Aliphatic heteromonocyclic compound
| Molecliar Framework |
Aliphatic heteromonocyclic compounds
| External Descriptors |
Not Available
| Ontology |
| Status |
Expected but not Quantified
| Origin |
Endogenous
| Biofunction |
Not Available
| Application |
Not Available
| Cellliar locations |
Not Available
| Physical Properties |
| State |
Solid
| Experimental Properties |
| Property |
Value |
Reference |
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogP-2.22Extrapolated
| Predicted Properties |
| Property |
Value |
Source |
Water Solubility16.9 mg/mLALOGPS
logP-2ALOGPS
logP-2.2ChemAxon
logS-1.1ALOGPS
pKa (Strongest Acidic)3.85ChemAxon
pKa (Strongest Basic)9.81ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count3ChemAxon
Polar Surface Area78.43 Å2ChemAxon
Rotatable Bond Count4ChemAxon
Refractivity54.36 m3·mol-1ChemAxon
Polarizability22.49 Å3ChemAxon
Number of Rings1ChemAxon
Bioavailability1ChemAxon
Rlie of FiveYesChemAxon
Ghose FilterYesChemAxon
Vebers RlieYesChemAxon
MDDR-like RlieYesChemAxon
| Spectra |
| Spectra |
Not Available
| Biological Properties |
| Cellliar Locations |
Not Available
| Biofluid Locations |
Not Available
| Tissue Location |
Not Available
| Pathways |
Not Available
| Normal Concentrations |
| Not Available |
| Abnormal Concentrations |
|
Not Available
| Associated Disorders and Diseases |
| Disease References |
None
| Associated OMIM IDs |
None
| External Links |
| DrugBank ID |
Not Available
| DrugBank Metabolite ID |
Not Available
| Phenol Explorer Compound ID |
Not Available
| Phenol Explorer Metabolite ID |
Not Available
| FoodDB ID |
Not Available
| KNApSAcK ID |
Not Available
| Chemspider ID |
Not Available
| KEGG Compound ID |
Not Available
| BioCyc ID |
Not Available
| BiGG ID |
Not Available
| Wikipedia Link |
Not Available
| NuGOwiki Link |
HMDB29030
| Metagene Link |
HMDB29030
| METLIN ID |
Not Available
| PubChem Compound |
Not Available
| PDB ID |
Not Available
| ChEBI ID |
Not Available
Product: ARA290
References |
| Synthesis Reference |
Not Available |
| Material Safety Data Sheet (MSDS) |
Not Available |
| General References |
- Hara Y, Kanagawa M, Kunz S, Yoshida-Moriguchi T, Satz JS, Kobayashi YM, Zhu Z, Burden SJ, Oldstone MB, Campbell KP: Like-acetylglucosaminyltransferase (LARGE)-dependent modification of dystroglycan at Thr-317/319 is required for laminin binding and arenavirus infection. Proc Natl Acad Sci U S A. 2011 Oct 18;108(42):17426-31. doi: 10.1073/pnas.1114836108. Epub 2011 Oct 10. [PubMed:21987822 ]
- Berglund A, Head RD, Welsh EA, Marshall GR: ProVal: a protein-scoring function for the selection of native and near-native folds. Proteins. 2004 Feb 1;54(2):289-302. [PubMed:14696191 ]
- Myara I, Marcon P, Lemonnier A, Chatelier B, Mangeot M: Determination of prolinase activity in plasma. Application to liver disease and its relation with prolidase activity. Clin Biochem. 1985 Aug;18(4):220-3. [PubMed:4042319 ]
- Dupuis B, Garcia N, Boels G: Efficacy of potato seeds disinfection products to control Erwinia spp. Commun Agric Appl Biol Sci. 2008;73(2):343-8. [PubMed:19226773 ]
|
PMID: 27734956
