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(2S,6R,7R,9R,13R,17S)-11-Hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione

Base Information
  • Chemical Name:(2S,6R,7R,9R,13R,17S)-11-Hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione
  • CAS No.:76-77-7
  • Molecular Formula:C22H30O6
  • Molecular Weight:390.477
  • Hs Code.:
  • DSSTox Substance ID:DTXSID30878618
  • Wikidata:Q104391551
(2S,6R,7R,9R,13R,17S)-11-Hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione

Synonyms:SCHEMBL1276840;DTXSID30878618;76-77-7;(2S,6R,7R,9R,13R,17S)-11-Hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione

Suppliers and Price of (2S,6R,7R,9R,13R,17S)-11-Hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione
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
  • AvaChem
  • Neoquassin
  • 1mg
  • $ 119.00
  • AvaChem
  • Neoquassin
  • 20mg
  • $ 690.00
  • AvaChem
  • Neoquassin
  • 10mg
  • $ 490.00
  • AvaChem
  • Neoquassin
  • 5mg
  • $ 290.00
  • Arctom
  • Neoquassine ≥98%
  • 5mg
  • $ 288.00
  • American Custom Chemicals Corporation
  • NEOQUASSIN 95.00%
  • 5MG
  • $ 504.78
Total 21 raw suppliers
Chemical Property of (2S,6R,7R,9R,13R,17S)-11-Hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione
Chemical Property:
  • Vapor Pressure:3.04E-15mmHg at 25°C 
  • Melting Point:228oC 
  • Refractive Index:1.626 
  • Boiling Point:567.5oC at 760 mmHg 
  • Flash Point:195.5oC 
  • PSA:82.06000 
  • Density:1.24g/cm3 
  • LogP:2.61080 
  • XLogP3:2.2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:6
  • Rotatable Bond Count:2
  • Exact Mass:390.20423867
  • Heavy Atom Count:28
  • Complexity:797
Purity/Quality:

98%min *data from raw suppliers

Neoquassin *data from reagent suppliers

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

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(O3)O)C)OC)C)C)OC
  • Isomeric SMILES:C[C@H]1C=C(C(=O)[C@]2([C@@H]1C[C@@H]3[C@@]4(C2C(=O)C(=C([C@@H]4CC(O3)O)C)OC)C)C)OC
Refernces

Highly enantioselective reduction of symmetrical diacetylaromatics with baker's yeast

10.1016/S0957-4166(97)00462-X

The research investigates the asymmetric reduction of various symmetrical diacetylaromatic compounds using baker's yeast (Saccharomyces cerevisiae) to obtain optically active secondary alcohols with high enantiomeric purity. The study explores the reduction of compounds such as 2,6-diacetylpyridine (la), 2,6-diacetylpyridine 1-oxide (lb), 1,2-diacetylb°enzene (lc), 1,3-diacetylbenzene (ld), 1,4-diacetylbenzene (le), 2,5-diacetylfuran (If), 2,5-diacetylthiophene (lg), and 2,5-diacetylpyrrole (lh). The researchers optimized reaction conditions to selectively produce monoalcohols over diols, achieving excellent yields and enantiomeric purities. Key chemicals involved in the research include the diacetylaromatic substrates, baker's yeast, sucrose, and various reagents used in the synthesis and analysis of the compounds, such as methoxymethoxyethyl groups, maleic acid, hydrogen peroxide, oxalyl chloride, dimethyl sulfoxide, and triethylamine. The study highlights the effectiveness of baker's yeast as a biocatalyst for enantioselective reductions under mild conditions, offering a valuable alternative to traditional chemical methods.

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