5-Éthynyl-2'-désoxycytidine - ≥98%(N) , CAS No.69075-47-4

CAS: 69075-47-4 Cat. No.: E156345 Formule: C₁₁H₁₃N₃O₄ Poids moléculaire: 251.24

GRADE & PURITY ≥98%(N)

Synonyms

AS-59861 | AKOS027253006 | Cytidine, 2'-deoxy-5-ethynyl- | D90593 | A900532 | MFCD22417249 | 5-Ethynyl-2'-deoxycytidine, (EdC), AldrichCPR | 5-Ethynyl-2'-deoxycytidine | SCHEMBL6906161 | DTXSID10567311 | 4-amino-5-ethynyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydrox

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

AS-59861 | AKOS027253006 | Cytidine, 2'-deoxy-5-ethynyl- | D90593 | A900532 | MFCD22417249 | 5-Ethynyl-2'-deoxycytidine, (EdC), AldrichCPR | 5-Ethynyl-2'-deoxycytidine | SCHEMBL6906161 | DTXSID10567311 | 4-amino-5-ethynyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydrox

Spécifications et pureté

≥98%(N)

Mécanismes biochimiques et physiologiques

Analogue de la 2'-désoxycytidine relativement non toxique. Alternative au BrdU (5-Bromo-2'-désoxyuridine) pour mesurer la synthèse de novo de l'ADN pendant la phase S. S'incorpore dans l'ADN en cours de réplication à la place de son analogue naturel, la t

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Type d'action

INHIBITOR

Note

Dans la mesure du possible, les solutions doivent être préparées et utilisées le même jour. Toutefois, si vous devez préparer des solutions de base à l'avance, nous vous recommandons de les conserver sous forme d'aliquotes dans des flacons hermétiques à -20°C. Ces aliquotes sont généralement utilisables pendant un mois. En général, ces solutions peuvent être utilisées pendant un mois. Avant utilisation, et avant d'ouvrir le flacon, nous vous recommandons de laisser votre produit s'équilibrer à température ambiante pendant au moins 1 heure. Besoin de plus de conseils sur la solubilité, l'utilisation et la manipulation ? Veuillez consulter notre page de questions fréquemment posées (FAQ) pour plus de détails.

Pureté

≥98%(N)

Noms et identifiants

• Pubchem Sid: 504767759
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504767759
• Sourires canoniques: C#CC1=CN(C(=O)N=C1N)C2CC(C(O2)CO)O
• IUPAC Name: 4-amino-5-ethynyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
• InChIKey: HMJSYXIPNSASJY-DJLDLDEBSA-N
• INCHI: 1S/C11H13N3O4/c1-2-6-4-14(11(17)13-10(6)12)9-3-7(16)8(5-15)18-9/h1,4,7-9,15-16H,3,5H2,(H2,12,13,17)/t7-,8+,9+/m0/s1
• Isomères SMILES: C#CC1=CN(C(=O)N=C1N)[C@H]2C[C@@H]([C@H](O2)CO)O
• WGK Allemagne: 3
• Poids moléculaire: 251.24
• Reaxy-Rn: 26363431
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=26363431&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • Classe Pyrimidine nucleosides
      • Subclass Pyrimidine 2'-deoxyribonucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• Classe: Pyrimidine nucleosides
• Subclass: Pyrimidine 2'-deoxyribonucleosides
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrimidine 2'-deoxyribonucleosides
• Alternative Parents: Pyrimidones Aminopyrimidines and derivatives Imidolactams Hydropyrimidines Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Azacyclic compounds Acetylides Primary amines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrimidine 2'-deoxyribonucleoside - Aminopyrimidine - Pyrimidone - Hydropyrimidine - Pyrimidine - Imidolactam - Tetrahydrofuran - Heteroaromatic compound - Secondary alcohol - Organoheterocyclic compound - Oxacycle - Acetylide - Azacycle - Hydrocarbon derivative - Alcohol - Organic oxide - Organopnictogen compound - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as pyrimidine 2'-deoxyribonucleosides. These are compounds consisting of a pyrimidine linked to a ribose which lacks a hydroxyl group at position 2.
• 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

Propriétés chimiques et physiques

• Point de fusion (°C): 190 °C(dec.)
• Poids moléculaire: 251.240 g/mol
• XLogP3: -1.500
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 251.091 Da
• Monoisotopic Mass: 251.091 Da
• Topological Polar Surface Area: 108.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 476.000
• 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

Foire aux questions

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 69075-47-4, the molecular formula is C11H13N3O4, and the molecular weight is 251.24 g/mol. InChIKey HMJSYXIPNSASJY-DJLDLDEBSA-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.