Cercosporin from Cercospora hayii

Base Information

Chemical Name:Cercosporin from Cercospora hayii
CAS No.:127094-74-0
Molecular Formula:C₂₉H₂₆O₁₀
Molecular Weight:534.519
Hs Code.:
NSC Number:234486
DSSTox Substance ID:DTXSID00960897,DTXSID801043885
Nikkaji Number:J18.014I
Wikipedia:Cercosporin
Wikidata:Q27163675,Q104978501
ChEMBL ID:CHEMBL1080283

Synonyms:cercosporin

Suppliers and Price of Cercosporin from Cercospora hayii

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
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Total 0 raw suppliers

Chemical Property of Cercosporin from Cercospora hayii

Chemical Property:

XLogP3:4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:534.15259702
Heavy Atom Count:39
Complexity:988

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(CC1=C2C3=C(C(=C(C4=C3C5=C6C2=C(C(=O)C=C6OCOC5=CC4=O)C(=C1OC)O)O)OC)CC(C)O)O

Technology Process of Cercosporin from Cercospora hayii

There total 3 articles about Cercosporin from Cercospora hayii 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: 50.0%

: 85656-98-0,85701-10-6
dimethylcercosporin

: 127094-74-0,150132-90-4
Cercosporin

Guidance literature:: dimethylcercosporin; With magnesium iodide; In tetrahydrofuran; diethyl ether; for 0.166667h; Inert atmosphere;

With water; ammonium chloride; In tetrahydrofuran; diethyl ether;
DOI:10.1021/jo9013854

Reference yield:

: 127094-74-0,150132-90-4
cercosporin

: 127094-74-0,150132-90-4
isocercosporin

Guidance literature:: In acetylacetone; Thermodynamic data; Rate constant; Equilibrium constant; activation enthalpy ΔH=20.0 kcal/mole, activation enthropy ΔS=20.8 e.u. of isomerisation was measured;
DOI:10.1016/0040-4020(82)85005-9