Epigallocatechin gallate 4'-palmitate

Base Information

• Chemical Name: Epigallocatechin gallate 4'-palmitate
• CAS No.: 507453-56-7
• Molecular Formula: C38H48O12
• Molecular Weight: 696.792
• UNII: 3H4430NO4A
• Nikkaji Number: J1.844.294I
• Wikidata: Q27257192

Synonyms:Egcg 4'-palmitate;Epigallocatechin gallate 4'-palmitate;UNII-3H4430NO4A;3H4430NO4A;507453-56-7;Benzoic acid, 3,4,5-trihydroxy-, (2R,3R)-2-(3,5-dihydroxy-4-((1-oxohexadecyl)oxy)phenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester;SCHEMBL16405331;Q27257192

Chemical Property of Epigallocatechin gallate 4'-palmitate

Chemical Property:

• PSA: 203.44000
• LogP: 7.91430
• XLogP3: 9.7
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 20
• Exact Mass: 696.31457696
• Heavy Atom Count: 50
• Complexity: 988

Purity/Quality:

95%+ or 98%+ ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC(=O)OC1=C(C=C(C=C1O)C2C(CC3=C(C=C(C=C3O2)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O
• Isomeric SMILES: CCCCCCCCCCCCCCCC(=O)OC1=C(C=C(C=C1O)[C@@H]2[C@@H](CC3=C(C=C(C=C3O2)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O

Technology Process of Epigallocatechin gallate 4'-palmitate

There total 4 articles about Epigallocatechin gallate 4'-palmitate 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: 90.6%

(-)-epigallocathechin gallate (2596-50-1,4233-96-9,5127-64-0,19065-20-4,107965-88-8,137766-94-0,989-51-5) + n-hexadecanoyl chloride (112-67-4) → (?)-epigallocatechin-3-gallate monopalmitate (507453-56-7)

Guidance literature:

With sodium acetate; In acetone; at 40 ℃; for 6h; Reagent/catalyst; Solvent;

DOI:10.3390/molecules26020393

Reference yield:

vinyl palmitate (693-38-9) + (-)-epigallocathechin gallate (2596-50-1,4233-96-9,5127-64-0,19065-20-4,107965-88-8,137766-94-0,989-51-5) → C38H48O12 (355120-39-7) + C38H48O12 (948837-65-8) + C38H48O12 (948837-66-9) + (?)-epigallocatechin-3-gallate monopalmitate (507453-56-7)

Guidance literature:

With Lipase PL from Alcaligenes sp.; In N,N-dimethyl-formamide; at 57 ℃; for 1.5h;

DOI:10.1016/j.bmcl.2008.02.020

Reference yield:

(-)-epigallocathechin gallate (2596-50-1,4233-96-9,5127-64-0,19065-20-4,107965-88-8,137766-94-0,989-51-5) + n-hexadecanoyl chloride (112-67-4) → C38H48O12 (355120-39-7) + C38H48O12 (948837-65-8) + C38H48O12 (948837-66-9) + (?)-epigallocatechin-3-gallate monopalmitate (507453-56-7)

Guidance literature:

With triethylamine; In tetrahydrofuran; at 0 - 20 ℃; for 24h;

DOI:10.1016/j.bmcl.2008.02.020

upstream raw materials:

vinyl palmitate

(-)-epigallocathechin gallate

n-hexadecanoyl chloride

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 507453-56-7 Benzoic acid, 3,4,5-trihydroxy-, (2R,3R)-2-[3,5-dihydroxy-4-[(1-oxohexadecyl)oxy]phenyl]-3,4-dihydro-5, 7-dihydroxy-2H-1-benzopyran-3-yl ester

Send

Send

Metric Ton KG G Pound L ML

Send

Send