palmitoyl CoA
TL;DR: palmitoyl CoA (CAS 188174-64-3) is a chemical compound with molecular formula C37H66N7O17P3S and molecular weight 1005.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] hexadecanethioate
Also Known As: palmitoyl-CoA, palmitoyl coenzyme A, palmitoyl CoA, palmityl-CoA, hexadecanoyl CoA
| Molecular Formula | C37H66N7O17P3S |
|---|---|
| Molecular Weight | 1005.34 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 389.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 34 |
| Exact Mass | 1005.34485 |
| Heavy Atoms | 65 |
| Complexity | 1620.0 |
Chemical Identifiers
| CAS Number | 188174-64-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=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 |
| InChIKey | MNBKLUUYKPBKDU-BBECNAHFSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
palmitoyl CoA (CAS 188174-64-3), with molecular formula C37H66N7O17P3S and molecular weight 1005.34 g/mol. IUPAC: S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] hexadecanethioate.
Chemical Property Profile of palmitoyl CoA
Property Insights of palmitoyl CoA
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for palmitoyl CoA. The TPSA of 389.0 Ų indicates high polarity, suggesting palmitoyl CoA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, palmitoyl CoA has 9 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of palmitoyl CoA?
The CAS number of palmitoyl CoA is 188174-64-3.
What is the molecular formula of palmitoyl CoA?
The molecular formula of palmitoyl CoA is C37H66N7O17P3S.
What is the molecular weight of palmitoyl CoA?
The molecular weight of palmitoyl CoA is 1005.34 g/mol.
Where can I buy palmitoyl CoA?
You can request a quote for palmitoyl CoA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for palmitoyl CoA?
Yes, KEHONG BIO provides custom synthesis services for palmitoyl CoA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.