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Merck
CN

A9627

Ala-Ala-Ala

≥98% (TLC)

Synonym(s):

Tri-L-alanine

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About This Item

Empirical Formula (Hill Notation):
C9H17N3O4
CAS Number:
Molecular Weight:
231.25
NACRES:
NA.26
PubChem Substance ID:
UNSPSC Code:
12352209
EC Number:
227-538-0
MDL number:
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Product Name

Ala-Ala-Ala,

Quality Level

InChI key

BYXHQQCXAJARLQ-ZLUOBGJFSA-N

InChI

1S/C9H17N3O4/c1-4(10)7(13)11-5(2)8(14)12-6(3)9(15)16/h4-6H,10H2,1-3H3,(H,11,13)(H,12,14)(H,15,16)/t4-,5-,6-/m0/s1

SMILES string

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

assay

≥98% (TLC)

form

powder

color

white

storage temp.

−20°C

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Application

Trialanine (Ala-Ala-Ala) may be used along with other short chain alanines, tetra- and penta-alanine, as model compounds to study physicochemical parameters of small peptides.

Storage Class

11 - Combustible Solids

wgk

WGK 1

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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Jos Oomens et al.
Journal of the American Society for Mass Spectrometry, 21(5), 698-706 (2010-02-26)
We present the first infrared spectra of a mass-selected deprotonated peptide anion (AlaAlaAla) and its decarboxylated fragment anion formed by collision induced dissociation. Spectra are obtained by IRMPD spectroscopy using an FTICR mass spectrometer in combination with the free electron
Tetsuo Asakura et al.
Journal of the American Chemical Society, 128(18), 6231-6238 (2006-05-04)
The structural analysis of natural protein fibers with mixed parallel and antiparallel beta-sheet structures by solid-state NMR is reported. To obtain NMR parameters that can characterize these beta-sheet structures, (13)C solid-state NMR experiments were performed on two alanine tripeptide samples:
Infrared multiple photon dissociation spectroscopy as structural confirmation for GlyGlyGlyH+ and AlaAlaAlaH+ in the gas phase. Evidence for amide oxygen as the protonation site.
Ronghu Wu et al.
Journal of the American Chemical Society, 129(37), 11312-11313 (2007-08-28)
E Rödel et al.
Organic & biomolecular chemistry, 4(3), 475-481 (2006-02-01)
A 20 K high resolution X-ray data set of L-Ala-L-Ala-L-Ala*1/2 H2O was measured using an ultra-low temperature laboratory setup, that combines area detection and a closed cycle helium cryostat. The charge density determination includes integration of atomic basins and topological
Jos Oomens et al.
Journal of the American Society for Mass Spectrometry, 20(2), 334-339 (2008-11-18)
Infrared multiple photon dissociation (IRMPD) spectroscopy is used to identify the structure of the b(2)(+) ion generated from protonated tri-alanine by collision induced dissociation (CID). The IRMPD spectrum of b(2)(+) differs markedly from that of protonated cyclo-alanine-alanine, demonstrating that the

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