Deoxyeritadenine

Base Information

• Chemical Name: Deoxyeritadenine
• CAS No.: 31701-90-3
• Molecular Formula: C₉H₁₁N₅O₃
• Molecular Weight: 237.218
• Wikidata: Q77513760
• Metabolomics Workbench ID: 44121
• Mol file: 31701-90-3.mol

Synonyms:Deoxyeritadenine;4-(6-aminopurin-9-yl)-2-hydroxybutanoic acid;SCHEMBL982442;CHEBI:178532;4-(6-amino-9H-purin-9-yl)-2-hydroxybutanoic acid

Chemical Property of Deoxyeritadenine

Chemical Property:

• PSA: 127.15000
• LogP: -0.17470
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 237.08618923
• Heavy Atom Count: 17
• Complexity: 290

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC(=C2C(=N1)N(C=N2)CCC(C(=O)O)O)N
• Description: A derivative of eritadenine, this base occurs in Lentinus adodes. It has the structure given above which is based upon chemical analysis and spectroscopic data.

Technology Process of Deoxyeritadenine

There total 1 articles about Deoxyeritadenine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 45.0%

→ 4-(Adenin-9-yl)-2-hydroxybutanoic acid (31701-90-3)

Guidance literature:

With sodium periodate; In water; at 0 ℃; for 3h;

DOI:10.1135/cccc19850262

Refernces