Dipotassium glutamyl-glutamate
Basic information
- CAS
3929-61-1- Standard SMILES
NC(CCC(=O)O)C(=O)NC(CCC(=O)O)C(=O)O- InChIKey
KOSRFJWDECSPRO-UHFFFAOYSA-N- Molecular formula
- C10H16N2O7
- Average molar mass
- 276.24 g/mol
- Monoisotopic mass
- 276.09575085
Names & identifiers
- Preferred name
- Dipotassium glutamyl-glutamate
- IUPAC
- 2-[(2-amino-4-carboxybutanoyl)amino]pentanedioic acid
- English name
- H-Glu-Glu-OH
- Molecular formula
- C10H16N2O7
- Molecular weight
- 276.24
Names & synonyms
H-D-Glu-D-Glu-OHDipotassium glutamyl-glutamateN-L-alpha-Glutamyl-L-glutamic acid6729-94-8Glu-Glu-OHL-Glutamic acid, N-L-.alpha.-glutamyl-SCHEMBL4353192-[(2-amino-4-carboxybutanoyl)amino]pentanedioic acidDTXSID70960026OEE-3080NSC335983AKOS014217780
Show more names
GLU-GLUDiglutamateL-GLUTAMYL-L-GLUTAMIC ACIDGlu-γGlu-OHH-Glu-Glu-OHL-Glu-L-Glu-OHArginine Impurityglutamyl-glutamicacid
NSC 335983NSC-335983LS-13842DB-0493982-[(2-amino-4-carboxy-butanoyl)amino]pentanedioic acidN-(2-Amino-4-carboxy-1-hydroxybutylidene)glutamic acid
Database identifiers
- CAS
3929-61-1- PubChem CID
- 100130
- DTXSID
DTXSID70960026
Properties
Computed structural properties
- XLogP
- -5.1
- Topological polar surface area
- 167 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 369
Physicochemical properties
- Melting point
- 187 ℃ · 187℃ (Decomposition) (ethanol )
- Boiling point
- 666 · 666.0±55.0 °C(Predicted)
- Density
- 1.51 g/cm3 · 1.51 g/cm3
- storage temp.
- 20 °C · −20°C
- solubility
- Aqueous Acid (Slightly), DMSO (Slightly, Heated, Sonicated)
- pka
- 2.97 · 2.97±0.10(Predicted)
- form
- Solid
- color
- White to Off-White
- Sequence
- H-Glu-Glu-OH
- 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)
- InChIKey
- KOSRFJWDECSPRO-UHFFFAOYSA-N
- SMILES
- NC(CCC(O)=O)C(=O)NC(CCC(O)=O)C(O)=O
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 26 · NA.26
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses(S)-2-((S)-2-Amino-4-carboxybutanamido)pentanedioic Acid is an amino acid derivative that is used in a variety of settings, including polypeptide synthesis. It has been used in the preparation of pharmaceuticals (using polypeptides) towards the treatment of diabetes and obesity.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: A dipeptide composed of two L-glutamic acid units joined by a peptide linkage.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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