Cis-9-octadecenoyl coenzyme a potassium salt

Base Information

• Chemical Name: Cis-9-octadecenoyl coenzyme a potassium salt
• CAS No.: 1716-06-9
• Molecular Formula: C39H68 N7 O17 P3 S
• Molecular Weight: 1031.99
• European Community (EC) Number: 216-998-8
• Mol file: 1716-06-9.mol

Synonyms:coenzyme A, oleoyl-;oleoyl-CoA;oleoyl-coenzyme A;oleoyl-coenzyme A, (E)-isomer;oleyl-CoA;oleyl-coenzyme A

Chemical Property of Cis-9-octadecenoyl coenzyme a potassium salt

Chemical Property:

• Boiling Point: °Cat760mmHg
• PKA: 1.16±0.50(Predicted)
• Flash Point: °C
• PSA: 418.36000
• Density: 1.51g/cm³
• LogP: 6.06520
• Storage Temp.: Store at 0°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 22
• Rotatable Bond Count: 35
• Exact Mass: 1031.36052589
• Heavy Atom Count: 67
• Complexity: 1700

Purity/Quality:

98%Min ^*data from raw suppliers

Oleoyl coenzyme A potassium salt ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=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: CCCCCCCCC=CCCCCCCCC(=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 Cis-9-octadecenoyl coenzyme a potassium salt

There total 2 articles about Cis-9-octadecenoyl coenzyme a potassium salt 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:

→ oleoyl-CoA (1716-06-9)

Guidance literature:

-Oelsaeure,CoA (S.517);

DOI:10.1111/j.1432-1033.1973.tb03087.x

Reference yield:

→ S-octadec-9-enoyl-coenzyme-A (1716-06-9,4752-14-1,14527-15-2)

Guidance literature:

CoA, trans-Δ9-Octadecensaeure (nach Lit. 17, 18);

DOI:10.1007/BF02533290

Refernces