Caffeoyl-coa

Base Information Edit

Chemical Name:Caffeoyl-coa
CAS No.:1021913-49-4
Molecular Formula:C₃₀H₄₂N₇O₁₉P₃S
Molecular Weight:929.686
Hs Code.:
DSSTox Substance ID:DTXSID501195067
Wikidata:Q27159631
Metabolomics Workbench ID:50133
Mol file:1021913-49-4.mol

Synonyms:caffeoyl-CoA;caffeoyl-coenzyme A;coenzyme A, caffeoyl-

Suppliers and Price of Caffeoyl-coa

Supply Marketing:Edit

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

Total 1 raw suppliers

Chemical Property of Caffeoyl-coa Edit

Chemical Property:

XLogP3:-4.3
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:24
Rotatable Bond Count:22
Exact Mass:929.14690430
Heavy Atom Count:60
Complexity:1670

Purity/Quality:: 98%,99%, ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)C=CC4=CC(=C(C=C4)O)O)O
Isomeric SMILES:CC(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)[C@H](C(=O)NCCC(=O)NCCSC(=O)/C=C/C4=CC(=C(C=C4)O)O)O

Technology Process of Caffeoyl-coa

There total 5 articles about Caffeoyl-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: 80.0%