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L-Alanyl-L-Glutamine

CAT: 1596-AR-A01557-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-A01557-01Size:10 Units
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CAS Number
39537-23-0
Synonyms
(S) -5-amino-2- ((S) -2-aminopropanamido) -5-oxopentanoic acid; Ala-Gln; Alanyl-Glutamine; Dipeptiven; Glutamine-S; H-Ala-Gln-Oh; L-Alanine-L-Glutamine; L-Alanyl-L-Glutamine; N (2) -L-Alanyl-L-Glutamine; L-Alany-L-Glutamine; N-L-Alanyl-L-Glutamine; L-Alanyl-L-Glutamide; L-Glutamine, L-Alanyl-; Glycyl-L-Glutamine (Dipeptiven) ; Dipetiven; L-Alanyl-L-Glutamin; Glutamine Dipeptide; L-Alanyl-L-Glutamine (Ala-Gln)
Molecular Formula
C8H15N3O4
Molecular Weight
217.23
API Name
Alanine

Chemical Information

L-Alanyl-L-Glutamine

Ala-Gln is a dipeptide formed from L-alanyl and L-glutamine residues. It has a role as a metabolite. It is a tautomer of an Ala-Gln zwitterion.

CAS Number39537-23-0
PubChem CID123935
IUPAC Name(2S)-5-amino-2-[[(2S)-2-aminopropanoyl]amino]-5-oxopentanoic acid
Molecular FormulaC8H15N3O4
Molecular Weight217.22
XLogP-4.4
Topological Polar Surface Area136
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count15
Formal Charge0
Complexity267
SMILES
C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)O)N
InChI
InChI=1S/C8H15N3O4/c1-4(9)7(13)11-5(8(14)15)2-3-6(10)12/h4-5H,2-3,9H2,1H3,(H2,10,12)(H,11,13)(H,14,15)/t4-,5-/m0/s1
InChIKey
HJCMDXDYPOUFDY-WHFBIAKZSA-N
Chemical Structure
2D Structure
2D structure of L-Alanyl-L-Glutamine
CAS: 39537-23-0
CID: 123935
Formula: C8H15N3O4
MW: 217.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight217.22
XLogP3-4.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass217.10625597
Monoisotopic Mass217.10625597
Topological Polar Surface Area136 Ų
Heavy Atom Count15
Formal Charge0
Complexity267
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