2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-2-yl]-7-methylpurin-9-ium-6-olate

Base Information

• Chemical Name: 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-2-yl]-7-methylpurin-9-ium-6-olate
• CAS No.: 26467-11-8
• Molecular Formula: C₁₁H₁₇N₅O₁₁P₂
• Molecular Weight: 457.23

Synonyms:7-Methylguanosine 5'-diphosphate sodium salt;J-001261

Chemical Property of 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-2-yl]-7-methylpurin-9-ium-6-olate

Chemical Property:

• XLogP3: -3.9
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 6
• Exact Mass: 457.03998037
• Heavy Atom Count: 29
• Complexity: 698

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1C=[N+](C2=C1C(=NC(=N2)N)[O-])C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O
• Isomeric SMILES: CN1C=[N+](C2=C1C(=NC(=N2)N)[O-])[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O

Technology Process of 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-2-yl]-7-methylpurin-9-ium-6-olate

There total 2 articles about 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-2-yl]-7-methylpurin-9-ium-6-olate 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:

C21H27N10O18P3(2-) → 7-methylguanine (578-76-7) + 7-methylguanosine-5'-monophosphate (10162-58-0,94889-81-3) + 7-methylguanosine 5'-diphosphate (26467-11-8) + Guanosine 5'-monophosphate (85-32-5) + C10H15N5O11P2 + P1-(ribofuranos-5-yl) P3-(guanosin-5'-yl) triphosphate

Guidance literature:

With copper(II) nitrate; at 60 ℃; Rate constant; Product distribution; pH 5.0; kinetic study of the Cu²⁺-promoted cleavage of mRNA 5'-cap analogs; partial reactions; time-dependent product distribution; half-lives of the partial reactions;

DOI:10.1080/07328319908045590

Reference yield:

C21H29N10O18P3 → 7-methylguanosine-5'-monophosphate (10162-58-0,94889-81-3) + 7-methylguanosine 5'-diphosphate (26467-11-8) + Guanosine 5'-monophosphate (85-32-5) + guanosine-5'-diphosphate (146-91-8)

Guidance literature:

With 1,4,7,10,13,16,19-heptaazacycloeicosane; In water; at 60 ℃; pH=7.2; Further Variations:; Reagents; pH-values; Kinetics;

DOI:10.1039/b306268f

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