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5,Pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester CAS

Base Information Edit
  • Chemical Name:5,Pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester CAS
  • CAS No.:192704-58-8
  • Molecular Formula:C25H34 O8 S
  • Molecular Weight:494.606
  • Hs Code.:
  • DSSTox Substance ID:DTXSID001304156
  • Mol file:192704-58-8.mol
5,Pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester CAS

Synonyms:192704-58-8;5,pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester cas;(2'R,7R,8S,9S,10R,11R,13S,14S)-Methyl 10,13-dimethyl-11-((methylsulfonyl)oxy)-3,5'-dioxo-1,2,3,4',5',6,7,8,9,10,11,12,13,14,15,16-hexadecahydro-3'H-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-7-carboxylate;methyl (7R,8S,9S,10R,11R,13S,14S,17R)-10,13-dimethyl-11-methylsulfonyloxy-3,5'-dioxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-7-carboxylate;DTXSID001304156;5,pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,met

Suppliers and Price of 5,Pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester CAS
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
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Total 12 raw suppliers
Chemical Property of 5,Pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester CAS Edit
Chemical Property:
  • PSA:121.42000 
  • LogP:4.02870 
  • XLogP3:1.1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:8
  • Rotatable Bond Count:4
  • Exact Mass:494.19743921
  • Heavy Atom Count:34
  • Complexity:1070
Purity/Quality:

99% *data from raw suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC12CCC(=O)C=C1CC(C3C2C(CC4(C3CCC45CCC(=O)O5)C)OS(=O)(=O)C)C(=O)OC
  • Isomeric SMILES:C[C@]12CCC(=O)C=C1C[C@H]([C@@H]3[C@@H]2[C@@H](C[C@]4([C@H]3CC[C@@]45CCC(=O)O5)C)OS(=O)(=O)C)C(=O)OC
Technology Process of 5,Pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester CAS

There total 6 articles about 5,Pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester CAS 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:
Guidance literature:
With triethylamine; In dichloromethane; at 10 - 15 ℃; for 2h; Reagent/catalyst; Temperature; Solvent; Inert atmosphere;
Guidance literature:
Multi-step reaction with 4 steps
1.1: potassium carbonate; benzalkonium chloride / N,N-dimethyl-formamide / 48 h / 90 °C
2.1: acetic acid / N,N-dimethyl-formamide / 0.5 h / 45 °C
2.2: 4 h
3.1: potassium carbonate / 0 - 20 °C
4.1: triethylamine / dichloromethane / 0 °C
With benzalkonium chloride; potassium carbonate; acetic acid; triethylamine; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1016/j.steroids.2012.04.017
Guidance literature:
Multi-step reaction with 3 steps
1.1: acetic acid / N,N-dimethyl-formamide / 0.5 h / 45 °C
1.2: 4 h
2.1: potassium carbonate / 0 - 20 °C
3.1: triethylamine / dichloromethane / 0 °C
With potassium carbonate; acetic acid; triethylamine; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1016/j.steroids.2012.04.017
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