Cholesteryl arachidate

Base Information

• Chemical Name: Cholesteryl arachidate
• CAS No.: 2573-03-7
• Molecular Formula: C₄₇H₈₄O₂
• Molecular Weight: 681.183
• UNII: UAM383C5F0
• DSSTox Substance ID: DTXSID60948611
• Metabolomics Workbench ID: 34676
• Nikkaji Number: J842.667H
• Wikidata: Q27290984
• Mol file: 2573-03-7.mol

Synonyms:Cholesteryl arachidate;2573-03-7;20:0 Cholesteryl ester;Cholesterol arachidate;Cholesteryl eicosanoate;cholest-5-en-3beta-yl eicosanoate;Cholesterol, eicosanoate;UAM383C5F0;UNII-UAM383C5F0;[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] icosanoate;CE(20:0);Cholest-5-en-3-ol (3beta)-, eicosanoate;cholest-5-en-3b-yl eicosanoate;cholest-5-en-3b-yl eicosanoic acid;Cholest-5-en-3-yl icosanoate;SCHEMBL4807234;DTXSID60948611;CHEBI:196788;LMST01020010;AKOS040756205;Cholest-5-en-3beta-yl eicosanoic acid;CHOLEST-5-EN-3.BETA.-YL EICOSANOATE;CHOLEST-5-EN-3-OL (3.BETA.)-, EICOSANOATE;Q27290984

Chemical Property of Cholesteryl arachidate

Chemical Property:

• PSA: 26.30000
• LogP: 14.98130
• Storage Temp.: −20°C
• XLogP3: 18.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 25
• Exact Mass: 680.64713192
• Heavy Atom Count: 49
• Complexity: 965

Purity/Quality:

97% ^*data from raw suppliers

Cholesteryl Arachidate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
• Isomeric SMILES: CCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C

Technology Process of Cholesteryl arachidate

There total 4 articles about Cholesteryl arachidate 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:

methyl arachidate (1120-28-1) + Cholesteryl acetate (604-35-3) → Cholesterylarachidat (2573-03-7)

Guidance literature:

With sodium ethanolate; at 80 - 90 ℃; under 20 - 30 Torr;

Reference yield:

eicosanoyl chloride (40140-09-8) + cholesterol (57-88-5) → Cholesterylarachidat (2573-03-7)

Guidance literature:

With chloroform;

Reference yield:

→ Cholesterylarachidat (2573-03-7)

Guidance literature:

Cholesterylacetat, NaOEt/Methylarachidat;

upstream raw materials:

eicosanoyl chloride

cholesterol

methyl arachidate

Cholesteryl acetate