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Glutamyl-Hydroxyproline

July 21, 2017
Common Name

Glutamyl-Hydroxyproline Description

Glutamyl-Hydroxyproline is a dipeptide composed of glutamate and hydroxyproline. 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

MOLSDFPDBSMILESInChI

Structure for HMDB28820 (Glutamyl-Hydroxyproline)

Synonyms

Value Source Glutamate hydroxyproline dipeptideHMDB e-HP DipeptideHMDB EHP dipeptideHMDB Glu-hproHMDB Glutamate-hydroxyproline dipeptideHMDB GlutamylhydroxyprolineHMDB L-Glutamyl-L-hydroxyprolineHMDB

Chemical Formlia

C10H15N2O6 Average Molecliar Weight

259.2359 Monoisotopic Molecliar Weight

259.093011222 IUPAC Name

4-amino-5-(2-carboxy-4-hydroxypyrrolidin-1-yl)-5-oxopentanoate Traditional Name

4-amino-5-(2-carboxy-4-hydroxypyrrolidin-1-yl)-5-oxopentanoate CAS Registry Number

Not Available SMILES

NC(CCC([O-])=O)C(=O)N1CC(O)CC1C(O)=O

InChI Identifier

InChI=1S/C10H16N2O6/c11-6(1-2-8(14)15)9(16)12-4-5(13)3-7(12)10(17)18/h5-7,13H,1-4,11H2,(H,14,15)(H,17,18)/p-1

InChI Key

NRSOKLBABRGMGJ-UHFFFAOYSA-M 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

  • Proline and derivatives
  • N-acyl-alpha amino acids
  • Alpha amino acid amides
  • Pyrrolidine carboxylic acids
  • N-acylpyrrolidines
  • Amino fatty acids
  • Hydroxy fatty acids
  • Heterocyclic fatty acids
  • Dicarboxylic acids and derivatives
  • Tertiary carboxylic acid amides
  • Secondary alcohols
  • Amino acids
  • Azacyclic compounds
  • Carboxylic acids
  • Organopnictogen compounds
  • Hydrocarbon derivatives
  • Carbonyl compounds
  • Monoalkylamines
  • Organic oxides
  • Organic anions

    • Substituents

  • Alpha-dipeptide
  • Proline or derivatives
  • N-acyl-alpha amino acid or derivatives
  • N-acyl-alpha-amino acid
  • Alpha-amino acid amide
  • Alpha-amino acid or derivatives
  • N-acylpyrrolidine
  • Pyrrolidine carboxylic acid
  • Pyrrolidine carboxylic acid or derivatives
  • Amino fatty acid
  • Hydroxy fatty acid
  • Heterocyclic fatty acid
  • Dicarboxylic acid or derivatives
  • Fatty acyl
  • Fatty acid
  • Pyrrolidine
  • Tertiary carboxylic acid amide
  • Amino acid
  • Amino acid or derivatives
  • Secondary alcohol
  • Carboxamide group
  • Carboxylic acid
  • Azacycle
  • Organoheterocyclic compound
  • Primary aliphatic amine
  • Organic nitrogen compound
  • Alcohol
  • Hydrocarbon derivative
  • Carbonyl group
  • Organic oxide
  • Organopnictogen compound
  • Amine
  • Organic oxygen compound
  • Primary amine
  • Organooxygen compound
  • Organonitrogen compound
  • Organic anion
  • 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-4.95Extrapolated

    Predicted Properties

    Property Value Source Water Solubility171.0 mg/mLALOGPS logP-3.2ALOGPS logP-4.9ChemAxon logS-0.21ALOGPS pKa (Strongest Acidic)3.17ChemAxon pKa (Strongest Basic)8.44ChemAxon Physiological Charge-1ChemAxon Hydrogen Acceptor Count7ChemAxon Hydrogen Donor Count3ChemAxon Polar Surface Area143.99 Å2ChemAxon Rotatable Bond Count5ChemAxon Refractivity68.43 m3·mol-1ChemAxon Polarizability24 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

    HMDB28820 Metagene Link

    HMDB28820 METLIN ID

    Not Available PubChem Compound

    Not Available PDB ID

    Not Available ChEBI ID

    Not Available

    Product: Taurochenodeoxycholic acid

    References Synthesis Reference Not Available Material Safety Data Sheet (MSDS) Not Available General References Not Available

    PMID: 25368340

    Last updated on