2′,5′-Dideoxyadenosine - Moligand™, ≥98% , CAS No.6698-26-6

CAS: 6698-26-6 Cat. No.: D335356 分子式: C₁₀H₁₃N₅O₂ 分子量: 235.24

GRADE & PURITY Moligand™, ≥98%

Synonyms

(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol | (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol' | 2',5'-Dideoxyadenosine - CAS 6698-26-6 | SCHEMBL284737 | (2R,3S,5R)-5-(6-Amino-9H-purin-9-yl)-2-methyltetrahydrofuran-3-ol | 2'5'-Dideoxyadenosi

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

概要

2′,5′-Dideoxyadenosine is a cell-permeable inhibitor of adenylate cyclase, a protein involved in cellular signaling and mast cell granule secretion in immunologic response.

Specifications

同義語

(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol | (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol' | 2',5'-Dideoxyadenosine - CAS 6698-26-6 | SCHEMBL284737 | (2R,3S,5R)-5-(6-Amino-9H-purin-9-yl)-2-methyltetrahydrofuran-3-ol | 2'5'-Dideoxyadenosi

仕様と純度

Moligand™, ≥98%

保管条件

Protected from light,Store at -20°C,Argon charged

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。

等級

Moligand™

アクションタイプ

INHIBITOR

純度

≥98%

製品の性質

• pKa: pKa: 3.82 (Predicted)

名前と識別子

• パブケム・シド: 528755037
• カノニカル・スマイル: CC1C(CC(O1)N2C=NC3=C(N=CN=C32)N)O
• IUPAC Name: (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol
• InChIKey: FFHPXOJTVQDVMO-DSYKOEDSSA-N
• INCHI: 1S/C10H13N5O2/c1-5-6(16)2-7(17-5)15-4-14-8-9(11)12-3-13-10(8)15/h3-7,16H,2H2,1H3,(H2,11,12,13)/t5-,6+,7-/m1/s1
• 異性体SMILES: C[C@@H]1[C@H](C[C@@H](O1)N2C=NC3=C(N=CN=C32)N)O
• WGKドイツ: 3
• 分子量: 235.24
• Reaxy-Rn: 25642290
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=25642290&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • 分類 2',5'-dideoxyribonucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• 分類: 2',5'-dideoxyribonucleosides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: 2',5'-dideoxyribonucleosides
• Alternative Parents: 6-aminopurines Aminopyrimidines and derivatives N-substituted imidazoles Imidolactams Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 2',5'-dideoxyribonucleoside - 6-aminopurine - Imidazopyrimidine - Purine - Aminopyrimidine - N-substituted imidazole - Pyrimidine - Imidolactam - Azole - Imidazole - Heteroaromatic compound - Tetrahydrofuran - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Alcohol - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as 2',5'-dideoxyribonucleosides. These are nucleosides characterized by a purine or pyrimidine base, which is N-linked to a 2',5'-dideoxyribose moiety.
• External Descriptors: Not available

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）

SK-N-SH (1499 Activities)

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関連ターゲット（非人間）

COS-7 (515 Activities)

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PC-12 (7051 Activities)

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作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in DMSO (30 mg/mL), water (20 mg/mL) at 50° C, ethanol (10 mg/mL) at 50° C, and methanol (10 mg/mL - clear, colorless solution).
• 屈折率: n20D1.83 (Predicted)
• 沸点（°C）: ~546.96° C at 760 mmHg (Predicted)
• 融点（°C）: 176-178° C
• 分子量: 235.240 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 235.107 Da
• Monoisotopic Mass: 235.107 Da
• Topological Polar Surface Area: 99.100 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 292.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• 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