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L-丙氨酰-L-丙氨酰-L-丙氨酸 三氟乙酸盐

    级别和纯度:
  • ≥98%
有货

库存信息

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库存信息

关闭
货号 (SKU) 包装规格 是否现货 价格 数量
A121365-100mg
100mg 现货 Stock Image
A121365-500mg
500mg 期货 Stock Image

基本描述

英文别名 EINECS 227-538-0 | alanylalanylalanine | Alanyl-alanyl-alanine | Tri-L-alanine | Ala-Ala-Ala | L-alanyl-L-alanyl-L-alanine | N-L-Alanyl-N-L-alanyl-L-alanine | CHEBI:73313 | BYXHQQCXAJARLQ-ZLUOBGJFSA-N | H-Ala-Ala-Ala-OH | (S)-2-((S)-2-((S)-2-Aminopropanam
规格或纯度 ≥98%
英文名称 Ala-Ala-Ala.TFA
应用 丙氨酰丙氨酰丙氨酸(Trialanine)可用于和其它短链丙氨酸,四-和五-丙氨酸合用作为模型化合物,研究小肽的物理化学参数。
储存温度 -20°C储存
运输条件 超低温冰袋运输
产品介绍

丙氨酰丙氨酰丙氨酸(Trialanine)可用于和其它短链丙氨酸,四-和五-丙氨酸合用作为模型化合物,研究小肽的物理化学参数。

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.

纯度 ≥98%

关联靶点(人)

SLC15A1 Tchem Oligopeptide transporter small intestine isoform (922 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID

关联靶点(其它种属)

Tpp2 Tripeptidyl aminopeptidase (141 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Saccharomyces cerevisiae (19171 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID

作用机制

作用机制 Action Type target ID Target Name Target Type Target Organism Binding Site Name 参考文献

名称和识别符

PubChem SID 504763863
EC号 227-538-0
分子类型 蛋白质
IIUPAC Name (2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]propanoic acid
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
InChi Key BYXHQQCXAJARLQ-ZLUOBGJFSA-N
Smiles CC(C(=O)NC(C)C(=O)NC(C)C(=O)O)N
Isomeric SMILES C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)N
分子量 231.25
Reaxy-Rn 1728077
Reaxys-RN link address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1728077&ln=

化学和物理性质

分子量 231.250 g/mol
XLogP3 -4.700
氢键供体数Hydrogen Bond Donor Count 4
氢键受体数Hydrogen Bond Acceptor Count 5
可旋转键计数Rotatable Bond Count 5
精确质量Exact Mass 231.122 Da
单同位素质量Monoisotopic Mass 231.122 Da
拓扑极表面积Topological Polar Surface Area 122.000 Ų
重原子数Heavy Atom Count 16
形式电荷Formal Charge 0
复杂度Complexity 292.000
同位素原子数Isotope Atom Count 0
定义的原子立体中心计数Defined Atom Stereocenter Count 3
未定义的原子立体中心计数Undefined Atom Stereocenter Count 0
定义的键立体中心计数Defined Bond Stereocenter Count 0
未定义的键立体中心计数Undefined Bond Stereocenter Count 0
所有立体化学键的总数The total count of all stereochemical bonds 0
共价键合单元计数Covalently-Bonded Unit Count 1

安全和危险性(GHS)

WGK Germany 3

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找到2个结果

批号(Lot Number) 证书类型 货号
B2010047 分析证书 A121365
C2301470 分析证书 A121365

引用文献

1. Fatma Eker,Kai Griebenow,Reinhard Schweitzer-Stenner.  (2003-07-03)  Stable conformations of tripeptides in aqueous solution studied by UV circular dichroism spectroscopy..  Journal of the American Chemical Society,  125  ((27)): (8178-8185).  [PMID:12837087]
2. E Rödel,M Messerschmidt,B Dittrich,P Luger.  (2006-02-01)  Atomic and bond topological properties of the tripeptide L-alanyl-L-alanyl-L-alanine based on its experimental charge density obtained at 20 K..  Organic & biomolecular chemistry,  ((3)): (475-481).  [PMID:16446805]
3. Ronghu Wu,Terry B McMahon.  (2007-08-28)  Infrared multiple photon dissociation spectroscopy as structural confirmation for GlyGlyGlyH+ and AlaAlaAlaH+ in the gas phase. Evidence for amide oxygen as the protonation site..  Journal of the American Chemical Society,  129  ((37)): (11312-11313).  [PMID:17718566]
4. Maxim V Fedorov,Jonathan M Goodman,Stephan Schumm.  (2007-10-11)  Solvent effects and hydration of a tripeptide in sodium halide aqueous solutions: an in silico study..  Physical chemistry chemical physics : PCCP,  ((40)): (5423-5435).  [PMID:17925969]
5. Jos Oomens,Sarah Young,Sam Molesworth,Michael van Stipdonk.  (2008-11-18)  Spectroscopic evidence for an oxazolone structure of the b(2) fragment ion from protonated tri-alanine..  Journal of the American Society for Mass Spectrometry,  20  ((2)): (334-339).  [PMID:19013079]
6. Reinhard Schweitzer-Stenner.  (2009-02-27)  Distribution of conformations sampled by the central amino acid residue in tripeptides inferred from amide I band profiles and NMR scalar coupling constants..  The journal of physical chemistry. B,  113  ((9)): (2922-2932).  [PMID:19243204]
7. Chi-Kit Siu,Yuzhu Guo,Irine S Saminathan,Alan C Hopkinson,K W Michael Siu.  (2009-12-31)  Optimization of parameters used in algorithms of ion-mobility calculation for conformational analyses..  The journal of physical chemistry. B,  114  ((2)): (1204-1212).  [PMID:20039660]
8. Kwang-Im Oh,Kyung-Koo Lee,Eun-Kyung Park,Dong-Geun Yoo,Geum-Sook Hwang,Minhaeng Cho.  (2010-11-03)  Circular dichroism eigenspectra of polyproline II and β-strand conformers of trialanine in water: Singular value decomposition analysis..  Chirality,  22 Suppl 1  (E186-E201).  [PMID:21038390]
9. Marianne T Bauer,Kelly A Gilmore,Sarah A Petty.  (2011-02-19)  Formation of β-sheets in glutamine and alanine tripeptides..  Biochemical and biophysical research communications,  406  ((3)): (348-352).  [PMID:21329666]
10. Baolei Jia,Sangmin Lee,Bang Phuong Pham,Jae Myeng Kwack,Haifeng Jin,Jian Li,Yuhan Wang,Gang-Won Cheong.  (2011-06-15)  Biochemical characterization of deblocking aminopeptidases from the hyperthermophilic archaeon Thermococcus kodakarensis KOD1..  Bioscience, biotechnology, and biochemistry,  75  ((6)): (1160-1166).  [PMID:21670507]
11. Siobhan Toal,Omid Amidi,Reinhard Schweitzer-Stenner.  (2011-07-07)  Conformational changes of trialanine induced by direct interactions between alanine residues and alcohols in binary mixtures of water with glycerol and ethanol..  Journal of the American Chemical Society,  133  ((32)): (12728-12739).  [PMID:21728315]
12. Pedro Salvador,I-Hsien Midas Tsai,J J Dannenberg.  (2011-09-08)  J-coupling constants for a trialanine peptide as a function of dihedral angles calculated by density functional theory over the full Ramachandran space..  Physical chemistry chemical physics : PCCP,  13  ((39)): (17484-17493).  [PMID:21897927]
13. Ming Chen,Michel A Cuendet,Mark E Tuckerman.  (2012-07-19)  Heating and flooding: a unified approach for rapid generation of free energy surfaces..  The Journal of chemical physics,  137  ((2)): (024102-024102).  [PMID:22803523]
14. Mandy C Green,Dmitri G Fedorov,Kazuo Kitaura,Joseph S Francisco,Lyudmila V Slipchenko.  (2013-03-01)  Open-shell pair interaction energy decomposition analysis (PIEDA): formulation and application to the hydrogen abstraction in tripeptides..  The Journal of chemical physics,  138  ((7)): (074111-074111).  [PMID:23445001]
15. Róisín Moriarty,Ciara A McManus,Matthew Lambert,Thea Tilley,Marc Devocelle,Marian Brennan,Steven W Kerrigan,Dermot Cox.  (2014-11-22)  A novel role for the fibrinogen Asn-Gly-Arg (NGR) motif in platelet function..  Thrombosis and haemostasis,  113  ((2)): (290-304).  [PMID:25413489]
16. Yi Sun,Moran Frenkel-Pinter,Charles L Liotta,Martha.  (2019-12-07)  The pH dependent mechanisms of non-enzymatic peptide bond cleavage reactions..  Physical chemistry chemical physics : PCCP,  22  ((1)): (107-113).  [PMID:31807746]
17. Tetsuo Asakura,Michi Okonogi,Yasumoto Nakazawa,Kazuo Yamauchi.  (2006-05-04)  Structural analysis of alanine tripeptide with antiparallel and parallel beta-sheet structures in relation to the analysis of mixed beta-sheet structures in Samia cynthia ricini silk protein fiber using solid-state NMR spectroscopy..  Journal of the American Chemical Society,  128  ((18)): (6231-6238).  [PMID:16669693]
18. Roman D Gorbunov,Phuong H Nguyen,Maja Kobus,Gerhard Stock.  (2007-02-17)  Quantum-classical description of the amide I vibrational spectrum of trialanine..  The Journal of chemical physics,  126  ((5)): (054509-054509).  [PMID:17302487]
19. Annegret Biegel,Sabine Gebauer,Bianka Hartrodt,Ilka Knütter,Klaus Neubert,Matthias Brandsch,Iris Thondorf.  (2007-07-24)  Recognition of 2-aminothiazole-4-acetic acid derivatives by the peptide transporters PEPT1 and PEPT2..  European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences,  32  ((1)): (69-76).  [PMID:17644326]
20. Kazuo Yamauchi,Michi Okonogi,Hiromichi Kurosu,Masataka Tansho,Tadashi Shimizu,Terry Gullion,Tetsuo Asakura.  (2007-12-07)  High field 17O solid-state NMR study of alanine tripeptides..  Journal of magnetic resonance (San Diego, Calif. : 1997),  190  ((2)): (327-332).  [PMID:18060815]
21. Wenfei Li,Shoji Takada.  (2009-06-11)  Self-learning multiscale simulation for achieving high accuracy and high efficiency simultaneously..  The Journal of chemical physics,  130  ((21)): (214108-214108).  [PMID:19508057]
22. Fabrizio Marinelli,Fabio Pietrucci,Alessandro Laio,Stefano Piana.  (2009-08-08)  A kinetic model of trp-cage folding from multiple biased molecular dynamics simulations..  PLoS computational biology,  ((8)): (e1000452-e1000452).  [PMID:19662155]
23. Kaicong Cai,Chen Han,Jianping Wang.  (2009-10-09)  Molecular mechanics force field-based map for peptide amide-I mode in solution and its application to alanine di- and tripeptides..  Physical chemistry chemical physics : PCCP,  11  ((40)): (9149-9159).  [PMID:19812835]
24. Jos Oomens,Jeffrey D Steill.  (2010-02-26)  The structure of deprotonated tri-alanine and its a3- fragment anion by IR spectroscopy..  Journal of the American Society for Mass Spectrometry,  21  ((5)): (698-706).  [PMID:20181492]
25. Phuong H Nguyen.  (2010-04-22)  Replica exchange simulation method using temperature and solvent viscosity..  The Journal of chemical physics,  132  ((14)): (144109-144109).  [PMID:20405987]
26. Edgardo Rivera-Tirado,Chrys Wesdemiotis.  (2011-07-15)  Fragmentation characteristics of b(n) (n=2-15) ions from protonated peptides..  Rapid communications in mass spectrometry : RCM,  25  ((16)): (2283-2290).  [PMID:21755549]
27. Zeeshan Ahmed,Shin Grace Chou,Karen Siegrist,David F Plusquellic.  (2011-01-01)  State-resolved THz spectroscopy and dynamics of crystalline peptide-water systems..  Faraday discussions,  150  (175-192).  [PMID:22457948]
28. Siobhan Toal,Derya Meral,Daniel Verbaro,Brigita Urbanc,Reinhard Schweitzer-Stenner.  (2013-03-02)  pH-Independence of trialanine and the effects of termini blocking in short peptides: a combined vibrational, NMR, UVCD, and molecular dynamics study..  The journal of physical chemistry. B,  117  ((14)): (3689-3706).  [PMID:23448349]

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