Ala-Tyr - ≥98%(HPLC) , CAS No.3061-88-9

CAS: 3061-88-9 Cat. No.: A121379 分子式: C₁₂H₁₆N₂O₄ 分子量: 252.27 Beilstein Registry Number: 14(4)2322 EC番号: 221-305-7

GRADE & PURITY ≥98%(HPLC)

Synonyms

N-L-Alanyl-L-tyrosine | (S)-2-((S)-2-Amino-propionylamino)-3-(4-hydroxy-phenyl)-propionic acid | AS-10477 | L-Ala-L-Tyr | F11948 | (2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid | (2S)-2-[[(2S)-2-Azaniumylpropanoyl]amino]-3-(4-hyd

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

同義語

N-L-Alanyl-L-tyrosine | (S)-2-((S)-2-Amino-propionylamino)-3-(4-hydroxy-phenyl)-propionic acid | AS-10477 | L-Ala-L-Tyr | F11948 | (2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid | (2S)-2-[[(2S)-2-Azaniumylpropanoyl]amino]-3-(4-hyd

仕様と純度

≥98%(HPLC)

生化学的・生理学的メカニズム

Alanyl dipeptides such as ala-leu, ala-lys, ala-gly, ala-pro, ala-tyr and ala-phe may be used in physicochemical studies or to evaluate dipeptide separation technologies. Alanyl dipeptides may also be used for studying cell uptake mechanisms, dipeptide me

保管条件

Store at -20°C

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥98%(HPLC)

名前と識別子

• パブケム・シド: 488186748
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/488186748
• カノニカル・スマイル: CC(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O)N
• IUPAC Name: (2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
• InChIKey: ALZVPLKYDKJKQU-XVKPBYJWSA-N
• INCHI: 1S/C12H16N2O4/c1-7(13)11(16)14-10(12(17)18)6-8-2-4-9(15)5-3-8/h2-5,7,10,15H,6,13H2,1H3,(H,14,16)(H,17,18)/t7-,10-/m0/s1
• 異性体SMILES: C[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)N
• WGKドイツ: 3
• 分子量: 252.27
• Beilstein: 14(4)2322
• Reaxy-Rn: 3211943
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3211943&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Not available
• Direct Parent: Peptides
• Alternative Parents: Tyrosine and derivatives Phenylalanine and derivatives N-acyl-alpha amino acids Phenylpropanoic acids Amphetamines and derivatives 1-hydroxy-2-unsubstituted benzenoids Amino acids Propargyl-type 1,3-dipolar organic compounds Carboximidic acids Carboxylic acids Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Monoalkylamines Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Alpha peptide - Tyrosine or derivatives - Phenylalanine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Amino acid or derivatives - Amino acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Primary amine - Organic oxide - Primary aliphatic amine - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
• External Descriptors: dipeptide

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

関連ターゲット（人間）

ACE Tclin Angiotensin-converting enzyme (1423 Activities)

Discover Target: ACE

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用メカニズム

化学的性質と物理的性質

• 溶解度: Solubility in 5mol/L HCl almost transparency
• 比旋光度［α］: 22° (C=2,5mol/L HCl)
• 分子量: 252.270 g/mol
• XLogP3: -3.500
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 252.111 Da
• Monoisotopic Mass: 252.111 Da
• Topological Polar Surface Area: 113.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 300.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

参考文献

1. Chusheng Liu, Haibin Li, Qiqin Wang, Jacques Crommen, Haibo Zhou, Zhengjin Jiang.  (2017)  Preparation and evaluation of 400 μm I.D. polymer-based hydrophilic interaction chromatography monolithic columns with high column efficiency.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:28629939] [10.1016/j.chroma.2017.06.034]

2. Wenhai Chu, Dongmei Li, Yang Deng, Naiyun Gao, Yansen Zhang, Yanping Zhu.  (2016)  Effects of UV/PS and UV/H2O2 pre-oxidations on the formation of trihalomethanes and haloacetonitriles during chlorination and chloramination of free amino acids and short oligopeptides.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2016.04.003]

よくある質問

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 3061-88-9, the molecular formula is C12H16N2O4, and the molecular weight is 252.27 g/mol. InChIKey ALZVPLKYDKJKQU-XVKPBYJWSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.