5′-Deoxyuridine - ≥98% , CAS No.15958-99-3

CAS: 15958-99-3 Cat. No.: D349863 Fórmula: C₉H₁₂N₂O₅ Peso molecular: 228.2

GRADE & PURITY ≥98%

Synonyms

5'-deoxyuridine | MFCD00075093 | 5'- Deoxyuridine | Uridine, 5'-deoxy- | SCHEMBL657542 | DTXSID20332158 | WUBAOANSQGKRHF-XVFCMESISA-N | A1-01935 | 1-((2R,3R,4S,5R)-3,4-dihydroxy-5-methyltetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione | 1-[(2R,3R,4S,5R)-3

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

5'-Deoxyuridine is a derivative of Uridine that is lacking the hydroxyl group on the hydroxymethyl moiety of the parent compound. 5'-Deoxyuridine has been described to be useful in the study of nucleoside transport proteins and serves as a probe compound for the specificity of nucleoside-handling mechanisms.

Product Application：

5’-Deoxyuridine is a uridine derivative used as a therapeutic agent for treating allergy, cancer, infection and autoimmune disease.

Specifications

Sinónimos

5'-deoxyuridine | MFCD00075093 | 5'- Deoxyuridine | Uridine, 5'-deoxy- | SCHEMBL657542 | DTXSID20332158 | WUBAOANSQGKRHF-XVFCMESISA-N | A1-01935 | 1-((2R,3R,4S,5R)-3,4-dihydroxy-5-methyltetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione | 1-[(2R,3R,4S,5R)-3

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

504758828

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758828

Sonrisas canónicas

CC1C(C(C(O1)N2C=CC(=O)NC2=O)O)O

IUPAC Name

1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]pyrimidine-2,4-dione

InChIKey

WUBAOANSQGKRHF-XVFCMESISA-N

INCHI

1S/C9H12N2O5/c1-4-6(13)7(14)8(16-4)11-3-2-5(12)10-9(11)15/h2-4,6-8,13-14H,1H3,(H,10,12,15)/t4-,6-,7-,8-/m1/s1

Isómeros SMILES

C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)O

Peso molecular

228.2

Reaxy-Rn

53284185

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=53284185&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • Clase 5'-deoxyribonucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• Clase: 5'-deoxyribonucleosides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: 5'-deoxyribonucleosides
• Alternative Parents: Glycosylamines Pyrimidones Hydropyrimidines Vinylogous amides Tetrahydrofurans Heteroaromatic compounds Ureas Secondary alcohols 1,2-diols Lactams Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 5'-deoxyribonucleoside - Glycosyl compound - N-glycosyl compound - Pyrimidone - Hydropyrimidine - Pyrimidine - Tetrahydrofuran - Vinylogous amide - Heteroaromatic compound - Urea - 1,2-diol - Secondary alcohol - Lactam - Organoheterocyclic compound - Azacycle - Oxacycle - Alcohol - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 5'-deoxyribonucleosides. These are nucleosides in which the oxygen atom at the 5'position of the ribose moiety has been replaced by another atom. The nucleobases here are limited to purine, pyrimidine, and pyridine derivatives.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: DMSO (Slightly), Methanol (Slightly)
• Peso molecular: 228.200 g/mol
• XLogP3: -1.500
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 228.075 Da
• Monoisotopic Mass: 228.075 Da
• Topological Polar Surface Area: 99.100 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 356.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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