ChemFOnt: Showing chemical card for Glutamylglutamic acid (CFc000010087)

Record Information

Version

1.0

Creation Date

2022-08-28 10:25:12 UTC

Update Date

2022-09-13 18:57:25 UTC

Chemfont ID

CFc000010087

Molecule Identification

Common Name

Glutamylglutamic acid

Definition

Glutamylglutamic acid is a dipeptide composed of two glutamic acid residues, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. Glutamylglutamic acid 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.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
H-Glu-glu-OH	ChEBI
H-L-Glu-L-glu-OH	ChEBI
L-Glu-L-glu	ChEBI
L-alpha-Glutamyl-L-glutamic acid	Kegg
Glu-glu	Kegg
L-a-Glutamyl-L-glutamate	Generator
L-a-Glutamyl-L-glutamic acid	Generator
L-alpha-Glutamyl-L-glutamate	Generator
L-Α-glutamyl-L-glutamate	Generator
L-Α-glutamyl-L-glutamic acid	Generator
Glutamylglutamate	Generator
E-E	HMDB
EE	HMDB
Glutamyl-glutamate	HMDB
Dipotassium glutamyl-glutamate	HMDB
Α-glu-glu	HMDB
Α-L-glu-L-glu	HMDB
Α-glutamylglutamic acid	HMDB
Α-glutamylglutamate	HMDB
Α-L-glutamyl-L-glutamic acid	HMDB
Α-L-glutamyl-L-glutamate	HMDB
N-Α-glutamylglutamic acid	HMDB
N-Α-glutamylglutamate	HMDB
N-Α-L-glutamyl-L-glutamic acid	HMDB
N-Α-L-glutamyl-L-glutamate	HMDB
N-L-Α-glutamylglutamic acid	HMDB
N-L-Α-glutamylglutamate	HMDB
N-L-Α-glutamyl-L-glutamic acid	HMDB
N-L-Α-glutamyl-L-glutamate	HMDB
alpha-Glu-glu	HMDB
alpha-L-Glu-L-glu	HMDB
alpha-Glutamylglutamic acid	HMDB
alpha-Glutamylglutamate	HMDB
alpha-L-Glutamyl-L-glutamic acid	HMDB
alpha-L-Glutamyl-L-glutamate	HMDB
N-alpha-Glutamylglutamic acid	HMDB
N-alpha-Glutamylglutamate	HMDB
N-alpha-L-Glutamyl-L-glutamic acid	HMDB
N-alpha-L-Glutamyl-L-glutamate	HMDB
N-L-alpha-Glutamylglutamic acid	HMDB
N-L-alpha-Glutamylglutamate	HMDB
N-L-alpha-Glutamyl-L-glutamic acid	HMDB
N-L-alpha-Glutamyl-L-glutamate	HMDB
NSC 335983	HMDB
L-Glutamyl-L-glutamic acid	HMDB
L-Glutamyl-L-glutamate	HMDB
N-Glutamylglutamic acid	HMDB
N-Glutamylglutamate	HMDB
N-L-Glutamyl-L-glutamic acid	HMDB
N-L-Glutamyl-L-glutamate	HMDB
Glutamyl-glutamic acid	HMDB
Glutamic acid glutamic acid dipeptide	HMDB
Glutamic acid glutamate dipeptide	HMDB
Glutamate glutamic acid dipeptide	HMDB
Glutamate glutamate dipeptide	HMDB
Glutamic acid-glutamic acid dipeptide	HMDB
Glutamic acid-glutamate dipeptide	HMDB
Glutamate-glutamic acid dipeptide	HMDB
Glutamate-glutamate dipeptide	HMDB
e-e Dipeptide	HMDB
EE dipeptide	HMDB
Glutamylglutamic acid	HMDB

Chemical Formula

C₁₀H₁₆N₂O₇

Average Molecular Weight

276.245

Monoisotopic Molecular Weight

276.095750863

IUPAC Name

(2S)-2-[(2S)-2-amino-4-carboxybutanamido]pentanedioic acid

Traditional Name

Glu-Glu

CAS Registry Number

3929-61-1

SMILES

N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O

InChI Identifier

InChI=1S/C10H16N2O7/c11-5(1-3-7(13)14)9(17)12-6(10(18)19)2-4-8(15)16/h5-6H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1

InChI Key

KOSRFJWDECSPRO-WDSKDSINSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Dipeptides

Alternative Parents

Substituents

Alpha-dipeptide
Glutamic acid or derivatives
N-acyl-alpha-amino acid
N-acyl-alpha amino acid or derivatives
N-acyl-l-alpha-amino acid
Alpha-amino acid amide
Alpha-amino acid or derivatives
Tricarboxylic acid or derivatives
Amino fatty acid
Fatty acyl
Fatty amide
N-acyl-amine
Amino acid
Secondary carboxylic acid amide
Amino acid or derivatives
Carboxamide group
Carboxylic acid
Organic nitrogen compound
Organonitrogen compound
Primary aliphatic amine
Organooxygen compound
Primary amine
Hydrocarbon derivative
Carbonyl group
Organic oxide
Organopnictogen compound
Amine
Organic oxygen compound
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

dipeptide (CHEBI:5390 )

Functional Ontology

Not Available

Endogenous (HMDB: HMDB0028818)

Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)
Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Equine

Horse (FooDB: FOOD00378)

Process

Not Available

Role

Not Available

Physical Properties

Predicted Properties

Property	Value	Source
Water Solubility	8.06 g/L	ALOGPS
logP	-3.2	ALOGPS
logP	-4.4	ChemAxon
logS	-1.5	ALOGPS
pKa (Strongest Acidic)	3.06	ChemAxon
pKa (Strongest Basic)	8.45	ChemAxon
Physiological Charge	-2	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	5	ChemAxon
Polar Surface Area	167.02 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	59.38 m³·mol⁻¹	ChemAxon
Polarizability	25.56 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0028818

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB111863

KNApSAcK ID

Not Available

Chemspider ID

388598

KEGG Compound ID

C01425

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

439500

PDB ID

Not Available

ChEBI ID

5390

Food Biomarker Ontology

Not Available

References

Synthesis Reference

Not Available

Showing chemical card for Glutamylglutamic acid (CFc000010087)

MOL for CFc000010087 (Glutamylglutamic acid)

3D MOL for CFc000010087 (Glutamylglutamic acid)

3D SDF for CFc000010087 (Glutamylglutamic acid)

3D-SDF for CFc000010087 (Glutamylglutamic acid)

PDB for CFc000010087 (Glutamylglutamic acid)

3D PDB for CFc000010087 (Glutamylglutamic acid)

SMILES for CFc000010087 (Glutamylglutamic acid)

INCHI for CFc000010087 (Glutamylglutamic acid)

Structure for CFc000010087 (Glutamylglutamic acid)

3D Structure for CFc000010087 (Glutamylglutamic acid)