2-Amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]propanoic acid

Base Information

Chemical Name:2-Amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]propanoic acid
CAS No.:35899-53-7
Molecular Formula:C13H18 N6 O5 S
Molecular Weight:370.389
Hs Code.:
DSSTox Substance ID:DTXSID00393782
Mol file:35899-53-7.mol

Synonyms:35899-53-7;2-amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]propanoic acid;S-(5'-Adenosyl)-L-cysteine;DTXSID00393782;2-Amino-3-({[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}sulfanyl)propanoic acid (non-preferred name)

Suppliers and Price of 2-Amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]propanoic acid

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
S-(5′-Adenosyl)-L-cysteine
100mg
$ 817.00

Sigma-Aldrich
S-(5′-Adenosyl)-L-cysteine
25mg
$ 264.00

Total 5 raw suppliers

Chemical Property of 2-Amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]propanoic acid

Chemical Property:

Melting Point:217 °C (approx, decomp)
Boiling Point:778.5±70.0 °C(Predicted)
PKA:2.08±0.10(Predicted)
PSA：207.93000
Density:2.00±0.1 g/cm3(Predicted)
LogP:-0.54570
Storage Temp.:−20°C
XLogP3:-3.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:6
Exact Mass:370.10593887
Heavy Atom Count:25
Complexity:490

Purity/Quality:

98%,99%, ^*data from raw suppliers

S-(5′-Adenosyl)-L-cysteine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CSCC(C(=O)O)N)O)O)N

Technology Process of 2-Amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]propanoic acid

There total 11 articles about 2-Amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]propanoic acid 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: 75.5%

: 99051-70-4
S-(2',3'-O-Isopropylideneadenosyl)-L-cysteine

: 35899-53-7
S-Adenosyl-L-cysteine

Guidance literature:: With sulfuric acid; at 40 ℃; overnight;

Reference yield: 61.0%

: 52-90-4
L-Cysteine

: 892-48-8
5'-deoxy-5'-chloroadenosine

: 35899-53-7
S-Adenosyl-L-cysteine

Guidance literature:: With sodium hydroxide; at 100 ℃; for 2h;
DOI:10.1021/jo020478g

Reference yield:

: [Fe^II(Cys)(CO)₂(CN)]

: 14031-35-7,17176-17-9,29908-03-0,75044-81-4,78548-84-2,79647-17-9,91279-78-6
S-Adenosyl-L-methionine

: 35899-53-7
S-Adenosyl-L-cysteine

Guidance literature:: With sodium dithionite; potassium chloride; Thermotoga maritima Fe?S maturase HydE enzyme; In aq. buffer; for 0.333333h; pH=8; Inert atmosphere; Enzymatic reaction;
DOI:10.1021/jacs.0c03802