Cladosporin

Base Information

Chemical Name:Cladosporin
CAS No.:35818-31-6
Molecular Formula:C₁₆H₂₀O₅
Molecular Weight:292.332
Hs Code.:
UNII:81PR0D5FI4
ChEMBL ID:CHEMBL448685
Metabolomics Workbench ID:99536
Nikkaji Number:J18.022J
Wikidata:Q27269262
Mol file:35818-31-6.mol

Synonyms:3,4-dihydro-6,8-dihydroxy-3-(6-methyltetrahydropyran- 2-ylmethyl)isocoumarin;asperentin;cladosporin;isocladosporin

Suppliers and Price of Cladosporin

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

TRC
Cladosporin
0.5mg
$ 185.00

American Custom Chemicals Corporation
CLADOSPORIN 95.00%
5MG
$ 498.89

Total 12 raw suppliers

Chemical Property of Cladosporin

Chemical Property:

Vapor Pressure:2.03E-12mmHg at 25°C
Boiling Point:543.4°Cat760mmHg
Flash Point:204°C
PSA：75.99000
Density:1.261g/cm³
LogP:2.52700
Storage Temp.:-20°C Freezer, Under inert atmosphere
Solubility.:Chloroform (Slightly), Ethanol (Slightly, Sonicated), Methanol (Slightly)
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:292.13107373
Heavy Atom Count:21
Complexity:385

Purity/Quality:

99% ^*data from raw suppliers

Cladosporin ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCCC(O1)CC2CC3=C(C(=CC(=C3)O)O)C(=O)O2
Isomeric SMILES:C[C@H]1CCC[C@@H](O1)C[C@H]2CC3=C(C(=CC(=C3)O)O)C(=O)O2
Uses Cladosporin is an antimalarial drug and an inhibitor of Plasmodium falciparum lysyl-?tRNA synthetase.

Technology Process of Cladosporin

There total 19 articles about Cladosporin 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: 63.0%

: 35931-68-1
(R)-3,4-dihydro-3-(((2R,6S)-tetrahydro-6-methyl-2H-pyran-2-yl)methyl)-6,8-dimethoxyisochromen-1-one

: 35818-31-6
cladosporin

Guidance literature:: With 3,5-dihydroxyphenol; iodine; tetra-(n-butyl)ammonium iodide; aluminium; In benzene; at 0 ℃; for 0.5h; Inert atmosphere;
DOI:10.1021/jo300805n

Reference yield:

: (2S,6R)-2-methyl-6-(oxiran-2-ylmethyl)tetrahydro-2H-pyran

: 35818-31-6
cladosporin

Guidance literature:: Multi-step reaction with 5 steps

1: (1R,2R)-(-)-N,N'-bis(3,5-di-tert-butylsalicydene)-1,2-cyclohexanediaminocobalt(II); acetic acid / toluene / 1 h / 20 °C

2: copper(l) iodide / tetrahydrofuran / -30 °C

3: toluene-4-sulfonic acid / dichloromethane / 1 h

4: Jones reagent / acetone / 1 h / 0 - 20 °C

5: 3,5-dihydroxyphenol; iodine; tetra-(n-butyl)ammonium iodide; aluminium / benzene / 0.5 h / 0 °C / Inert atmosphere

With copper(l) iodide; Jones reagent; (1R,2R)-(-)-N,N'-bis(3,5-di-tert-butylsalicydene)-1,2-cyclohexanediaminocobalt(II); 3,5-dihydroxyphenol; iodine; tetra-(n-butyl)ammonium iodide; toluene-4-sulfonic acid; acetic acid; aluminium; In tetrahydrofuran; dichloromethane; acetone; toluene; benzene; 3: oxa-Pictet-Spengler cyclization / 4: Jones oxidation;
DOI:10.1021/jo300805n

Reference yield:

: 1381766-09-1
(2R,6S)-2-allyltetrahydro-6-methyl-2H-pyran

: 35818-31-6
cladosporin

Guidance literature:: Multi-step reaction with 6 steps

1: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 10 h / 0 - 20 °C

2: (1R,2R)-(-)-N,N'-bis(3,5-di-tert-butylsalicydene)-1,2-cyclohexanediaminocobalt(II); acetic acid / toluene / 1 h / 20 °C

3: copper(l) iodide / tetrahydrofuran / -30 °C

4: toluene-4-sulfonic acid / dichloromethane / 1 h

5: Jones reagent / acetone / 1 h / 0 - 20 °C

6: 3,5-dihydroxyphenol; iodine; tetra-(n-butyl)ammonium iodide; aluminium / benzene / 0.5 h / 0 °C / Inert atmosphere

With copper(l) iodide; Jones reagent; (1R,2R)-(-)-N,N'-bis(3,5-di-tert-butylsalicydene)-1,2-cyclohexanediaminocobalt(II); 3,5-dihydroxyphenol; iodine; tetra-(n-butyl)ammonium iodide; toluene-4-sulfonic acid; acetic acid; 3-chloro-benzenecarboperoxoic acid; aluminium; In tetrahydrofuran; dichloromethane; acetone; toluene; benzene; 4: oxa-Pictet-Spengler cyclization / 5: Jones oxidation;
DOI:10.1021/jo300805n