2'-Deoxyadenosine-5'-diphosphate

Base Information

• Chemical Name: 2'-Deoxyadenosine-5'-diphosphate
• CAS No.: 2793-06-8
• Molecular Formula: C10H15N5O9P2
• Molecular Weight: 411.205
• European Community (EC) Number: 276-280-5
• UNII: APQ916I0QD
• DSSTox Substance ID: DTXSID90950621
• Nikkaji Number: J247.700I
• Wikipedia: Deoxyadenosine_diphosphate
• Wikidata: Q27098417
• Metabolomics Workbench ID: 49893
• Mol file: 2793-06-8.mol

Synonyms:deoxyadenosine diphosphate;deoxyadenosine diphosphate magnesium salt

Chemical Property of 2'-Deoxyadenosine-5'-diphosphate

Chemical Property:

• PSA: 231.99000
• LogP: -0.13560
• XLogP3: -3.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 6
• Exact Mass: 411.03450107
• Heavy Atom Count: 26
• Complexity: 607

Purity/Quality:

2'-DEOXYADENOSINE-5'-DIPHOSPHATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OP(=O)(O)O)O
• Isomeric SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OP(=O)(O)O)O

Technology Process of 2'-Deoxyadenosine-5'-diphosphate

There total 2 articles about 2'-Deoxyadenosine-5'-diphosphate 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: 21.0%

(2-Trityloxy-ethyl)-phosphoramidic acid mono-[(2R,3S,5R)-5-(6-amino-purin-9-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester; compound with tributyl-amine (110526-59-5) → d-ADP (2793-06-8) + dATP (1927-31-7)

Guidance literature:

With pyrophosphoric acid; In N,N-dimethyl-formamide; at 40 ℃; for 288h;

DOI:10.1016/S0040-4039(00)85288-0

Reference yield:

2'-deoxyadenosine-5'-monophosphoric acid (653-63-4) → d-ADP (2793-06-8) + dATP (1927-31-7)

Guidance literature:

With phosphoric acid; kidney-extract; ATP;

DOI:10.1016/0006-3002(54)90295-4

Reference yield:

d-ADP (2793-06-8) → 2'-deoxyadenosine-5'-monophosphoric acid (653-63-4)

Guidance literature:

With Tris-Cl buffer; water; magnesium sulfate; at 74 ℃; pH=8.8; Kinetics;

DOI:10.1080/15257770701571768

upstream raw materials:

2'-deoxyadenosine-5'-monophosphoric acid

(2-Trityloxy-ethyl)-phosphoramidic acid mono-[(2R,3S,5R)-5-(6-amino-purin-9-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester; compound with tributyl-amine

Downstream raw materials:

2'-deoxyadenosine-5'-monophosphoric acid

dATP

2'-deoxy-D-adenosine

Refernces

• 1、 SABLE,WILBER,COHEN,KANE. "Desoxyadenylic acid as acceptor for high energy phosphate.". . p. 156 - 158. Retrieved 2007/11/11.