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

CAS: 6698-26-6 Cat. No.: D335356 분자식: C₁₀H₁₃N₅O₂ 분자량: 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

개요

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

동의어

(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

사양 및 순도

Moligand™, ≥98%

보관 조건

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

배송

Ice chest + Ice pads

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등급

Moligand™

작업 유형

INHIBITOR

순수함

≥98%

제품 특성

• pKa: pKa: 3.82 (Predicted)

이름과 식별자

• Pubchem Sid: 528755037
• 정식 스마일: 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
• 이성체 SMILES: C[C@@H]1[C@H](C[C@@H](O1)N2C=NC3=C(N=CN=C32)N)O
• WGK 독일: 3
• 분자량: 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
    • 분류 2',5'-dideoxyribonucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• 분류: 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
• 설명: 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

관련 대상(인간)

SK-N-SH (1499 Activities)

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

관련 대상(비인간)

COS-7 (515 Activities)

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PC-12 (7051 Activities)

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작용 메커니즘

화학 및 물리적 특성

• 용해성: 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).
• 굴절률: n20D1.83 (Predicted)
• 끓는점(°C): ~546.96° C at 760 mmHg (Predicted)
• 녹는점(°C): 176-178° C
• 분자량: 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