L-Abrine - 2mM in DMSO , CAS No.526-31-8

CAS: 526-31-8 Cat. No.: L424517 分子式: C₁₂H₁₄N₂O₂ 分子量: 218.26 Beilstein Registry Number: 86638 EC番号: 208-388-5

GRADE & PURITY 2mM in DMSO

Synonyms

AM9355 | MFCD00005645 | NCI60_004285 | L-Abrine, 99% | PB17033 | L-Abrine | SCHEMBL18778 | E9M | C02983 | N-a-Methyl-L-tryptophan | N-Metil-L-triptofano | s5828 | N-Methyl-L-tryptophan | AC-34880 | Benzeneethanol, beta-[2-(dimethylamino)propyl]-alpha-ethy

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

概要

Biochemical effects:
Indole amino acids that exhibit free radical scavenging and antioxidant properties in vitro.

Specifications

同義語

AM9355 | MFCD00005645 | NCI60_004285 | L-Abrine, 99% | PB17033 | L-Abrine | SCHEMBL18778 | E9M | C02983 | N-a-Methyl-L-tryptophan | N-Metil-L-triptofano | s5828 | N-Methyl-L-tryptophan | AC-34880 | Benzeneethanol, beta-[2-(dimethylamino)propyl]-alpha-ethy

仕様と純度

2mM in DMSO

保管条件

Store at -80°C

入荷

Dry ice packs + Cold packs

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。

名前と識別子

カノニカル・スマイル

CNC(CC1=CNC2=CC=CC=C21)C(=O)O

IUPAC Name

(2S)-3-(1H-indol-3-yl)-2-(methylamino)propanoic acid

InChIKey

CZCIKBSVHDNIDH-NSHDSACASA-N

INCHI

1S/C12H14N2O2/c1-13-11(12(15)16)6-8-7-14-10-5-3-2-4-9(8)10/h2-5,7,11,13-14H,6H2,1H3,(H,15,16)/t11-/m0/s1

異性体SMILES

CN[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O

WGKドイツ

3

分子量

218.26

Beilstein

86638

Reaxy-Rn

86640

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=86640&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
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alpha amino acids
              • Level8 L-alpha-amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives - Alpha amino acids
• Direct Parent: L-alpha-amino acids
• Alternative Parents: 3-alkylindoles Aralkylamines Substituted pyrroles Benzenoids Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 3-alkylindole - L-alpha-amino acid - Indole - Indole or derivatives - Aralkylamine - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Amino acid - Azacycle - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom.
• External Descriptors: N-methyl-L-alpha-amino acid - L-tryptophan derivative

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

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作用メカニズム

化学的性質と物理的性質

• 比旋光度［α］: [α]20/D +65°, c = 1 in 0.5 M NaOH
• 融点（°C）: >300 °C
• 分子量: 218.250 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 218.106 Da
• Monoisotopic Mass: 218.106 Da
• Topological Polar Surface Area: 65.099 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 257.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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

よくある質問

How should this product be stored?

Store at ?80 °C. Ultra-low temperature storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships frozen with dry ice and cold packs. Unpack on arrival and transfer it to the storage condition stated above; handle dry ice with insulated gloves in a ventilated area.

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

The CAS Number is 526-31-8, the molecular formula is C12H14N2O2, and the molecular weight is 218.26 g/mol. InChIKey CZCIKBSVHDNIDH-NSHDSACASA-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.