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A-L-A

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Description
A-L-A
CAS Number
54865-21-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
273.33
Molecular Formula
C12H23N3O4
Notes
Research use only, not for human use.
Receptor
Other Targets

Chemical Information

Ala-Leu-Ala

Ala-Leu-Ala is a tripeptide composed of L-alanine, L-leucine and L-alanine joined in sequence by peptide linkages. It is functionally related to a L-leucine and a L-alanine. It is a tautomer of an Ala-Leu-Ala zwitterion.

CAS Number54865-21-3
PubChem CID7016119
IUPAC Name(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylpentanoyl]amino]propanoic acid
Molecular FormulaC12H23N3O4
Molecular Weight273.33
XLogP-3.4
Topological Polar Surface Area122
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count19
Formal Charge0
Complexity344
SMILES
C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)N
InChI
InChI=1S/C12H23N3O4/c1-6(2)5-9(15-10(16)7(3)13)11(17)14-8(4)12(18)19/h6-9H,5,13H2,1-4H3,(H,14,17)(H,15,16)(H,18,19)/t7-,8-,9-/m0/s1
InChIKey
HCZXHQADHZIEJD-CIUDSAMLSA-N
Chemical Structure
2D Structure
2D structure of Ala-Leu-Ala
CAS: 54865-21-3
CID: 7016119
Formula: C12H23N3O4
MW: 273.33
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight273.33
XLogP3-3.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass273.16885622
Monoisotopic Mass273.16885622
Topological Polar Surface Area122 Ų
Heavy Atom Count19
Formal Charge0
Complexity344
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes