Chenodeoxycholic acid disulfate

Base Information

Chemical Name:Chenodeoxycholic acid disulfate
CAS No.:60262-91-1
Molecular Formula:C₂₄H₄₀O₁₀S₂
Molecular Weight:552.708
Hs Code.:
DSSTox Substance ID:DTXSID001245673
Metabolomics Workbench ID:36966
Wikidata:Q76423507
Mol file:60262-91-1.mol

Synonyms:Chenodeoxycholic acid disulfate;Chenodeoxycholic acid, disulfate;Chenodeoxycholic acid disulphate;CHEBI:166726;DTXSID001245673;LMST05020025;60262-91-1;3alpha,7alpha-disulfooxy-5beta-cholan-24-oic acid;(3alpha,5beta,7alpha)-3,7-Bis(sulfooxy)cholan-24-oic acid;"(4R)-4-((3R,5S,7R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-bis(sulfooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid";(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-disulooxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

Suppliers and Price of Chenodeoxycholic acid disulfate

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

Total 1 raw suppliers

Chemical Property of Chenodeoxycholic acid disulfate

Chemical Property:

PKA:-3.54±0.18(Predicted)
Density:1.41±0.1 g/cm3(Predicted)
XLogP3:4.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:552.20628982
Heavy Atom Count:36
Complexity:1050

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)OS(=O)(=O)O)C)OS(=O)(=O)O)C
Isomeric SMILES:C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)OS(=O)(=O)O)C)OS(=O)(=O)O)C

Technology Process of Chenodeoxycholic acid disulfate

There total 1 articles about Chenodeoxycholic acid disulfate 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: