Adenosine 5'-phosphorothioate

Base Information

Chemical Name:Adenosine 5'-phosphorothioate
CAS No.:19341-57-2
Molecular Formula:C10H14 N5 O6 P S
Molecular Weight:363.291
Hs Code.:
DSSTox Substance ID:DTXSID30172946
Nikkaji Number:J557.298C
Wikidata:Q27465464
ChEMBL ID:CHEMBL574816
Mol file:19341-57-2.mol

Synonyms:adenosine 5'-O-thiomonophosphate;adenosine 5'-phosphorothioate;adenosine 5'-phosphorothioate, sodium salt;adenosine 5'-thiophosphate;adenosine-5'-O-thiomonophosphate;AMP-S;AMPS cpd;thiophosphoryl adenylic acid

Suppliers and Price of Adenosine 5'-phosphorothioate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
Adenosine 5′-O-thiomonophosphate dilithium salt ≥98%
25 mg
$ 311.00

American Custom Chemicals Corporation
ADENSINE-5'-OXO-THIOMONOPHOSPHATE DILITHIUM SALT 98.00%
5MG
$ 496.32

American Custom Chemicals Corporation
ADENSINE-5'-OXO-THIOMONOPHOSPHATE DILITHIUM SALT 98.00%
1MG
$ 118.65

Total 3 raw suppliers

Chemical Property of Adenosine 5'-phosphorothioate

Chemical Property:

Boiling Point:785.1°Cat760mmHg
PKA:1.11±0.50(Predicted)
Flash Point:428.6°C
PSA：203.78000
Density:2.25g/cm³
LogP:0.36160
Storage Temp.:−20°C
XLogP3:-1.8
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:4
Exact Mass:363.04024135
Heavy Atom Count:23
Complexity:485

Purity/Quality:

99% ^*data from raw suppliers

Adenosine 5′-O-thiomonophosphate dilithium salt ≥98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 20/21/22-36
Safety Statements: 26-36/37/39-45-7/9

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=S)(O)O)O)O)N
Isomeric SMILES:C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=S)(O)O)O)O)N

Technology Process of Adenosine 5'-phosphorothioate

There total 9 articles about Adenosine 5'-phosphorothioate 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: 80.0%

: 58-61-7
adenosine

: 19341-57-2
AMPS

Guidance literature:: With 2,6-dimethylpyridine; trichlorothiophosphine; In various solvent(s); at 5 ℃; for 0.75h;
DOI:10.1021/jo00178a028

Reference yield: 47.0%

: 9-[(3aR,4R,6R,6aR)-2,2-Dimethyl-6-(2-thioxo-2λ⁵-[1,3,2]dioxaphospholan-2-yloxymethyl)-tetrahydro-furo[3,4-d][1,3]dioxol-4-yl]-9H-purin-6-ylamine

: 19341-57-2
AMPS

Guidance literature:: Multistep reaction;
DOI:10.1080/15257779908041610

Reference yield:

: 13241-24-2
2',3'-O-ethoxymethylene-N⁶-dimethylaminomethyleneadenosine

: 61-19-8,24937-83-5,67583-85-1
5'-adenosine monophosphate

: 19341-57-2
AMPS

: 58-61-7
adenosine

Guidance literature:: With 1H-imidazole; trichlorophosphate; Yield given. Multistep reaction. Title compound not separated from byproducts; 1.) acetonitrile, room temp. 3 days; 2.) 50percent CH₃COOH, 50 deg C, 1 h.;