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Phenylalanylglutamate

CAT: 0013-GTR19222931-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19222931-01Size:25 mg
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Description
Phenylalanylglutamate is an expected dipeptide metabolite derived from phenylalanine and glutamate during protein catabolism. While not yet confirmed in human systems, it serves as a research tool for studying peptide degradation pathways and intermediary metabolism in both in vitro and in vivo experimental models.
CAS Number
3617-45-6
Smiles
C ([C@@H] (C (N[C@@H] (CCC (O) =O) C (O) =O) =O) N) C1=CC=CC=C1
Molecular Formula
C14H18N2O5
Molecular Weight
294.30
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

L-phenylalanyl-L-glutamic acid

Phe-Glu is a dipeptide formed from L-phenylalanine and L-glutamic acid residues. It has a role as a metabolite.

CAS Number3617-45-6
PubChem CID151134
IUPAC Name(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]pentanedioic acid
Molecular FormulaC14H18N2O5
Molecular Weight294.30
XLogP-3
Topological Polar Surface Area130
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count21
Formal Charge0
Complexity380
SMILES
C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)N
InChI
InChI=1S/C14H18N2O5/c15-10(8-9-4-2-1-3-5-9)13(19)16-11(14(20)21)6-7-12(17)18/h1-5,10-11H,6-8,15H2,(H,16,19)(H,17,18)(H,20,21)/t10-,11-/m0/s1
InChIKey
JXWLMUIXUXLIJR-QWRGUYRKSA-N
Chemical Structure
2D Structure
2D structure of L-phenylalanyl-L-glutamic acid
CAS: 3617-45-6
CID: 151134
Formula: C14H18N2O5
MW: 294.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight294.30
XLogP3-3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass294.12157168
Monoisotopic Mass294.12157168
Topological Polar Surface Area130 Ų
Heavy Atom Count21
Formal Charge0
Complexity380
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5783544Phenylalanylglutamate

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