Lauroyl-coa

Base Information

• Chemical Name: Lauroyl-coa
• CAS No.: 6244-92-4
• Molecular Formula: C₃₃H₅₈N₇O₁₇P₃S
• Molecular Weight: 949.848
• DSSTox Substance ID: DTXSID10211483
• Wikidata: Q27098076
• Metabolomics Workbench ID: 38365
• Mol file: 6244-92-4.mol

Synonyms:coenzyme A, lauroyl-;dodecanoyl-CoA;lauroyl-CoA;lauroyl-coenzyme A

Chemical Property of Lauroyl-coa

Chemical Property:

• Refractive Index: 1.65
• PSA: 425.34000
• Density: 1.62 g/cm³
• LogP: 4.84740
• Storage Temp.: Store at 0°C
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 22
• Rotatable Bond Count: 30
• Exact Mass: 949.28227557
• Heavy Atom Count: 61
• Complexity: 1550

Purity/Quality:

99% ^*data from raw suppliers

Lauroyl coenzyme A ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
• Isomeric SMILES: CCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O

Technology Process of Lauroyl-coa

There total 1 articles about Lauroyl-coa 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:

lauric acid (143-07-7) + coenzyme A (900498-43-3) → lauroyl-CoA (6244-92-4)

Guidance literature:

With ATP; magnesium chloride; In water; at 25 ℃; for 0.166667h; pH=7.8; Enzyme kinetics;

DOI:10.1271/bbb.69.819

Reference yield:

malonyl-CoA (524-14-1) + lauroyl-CoA (6244-92-4) → 4-OH-6-UP (81017-03-0) + 4-hydroxy-6-(2-oxotridecyl)pyran-2-one

Guidance literature:

With ethylenediaminetetraacetic acid; recombinant Arachis hypogaea stilbene synthase; In various solvent(s); at 30 ℃; for 0.333333h; pH=8.0; Enzyme kinetics;

DOI:10.1016/j.phytochem.2004.08.005

upstream raw materials:

lauric acid

coenzyme A

Downstream raw materials:

4-OH-6-UP

Refernces