1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC
TL;DR: 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC (CAS 59403-54-2) is a chemical compound with molecular formula C46H80NO8P and molecular weight 805.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-2-docosa-4,7,10,13,16,19-hexaenoyloxy-3-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC
| Molecular Formula | C46H80NO8P |
|---|---|
| Molecular Weight | 805.56 g/mol |
| LogP | 12.5 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 40 |
| Exact Mass | 805.56213 |
| Heavy Atoms | 56 |
| Complexity | 1180.0 |
Chemical Identifiers
| CAS Number | 59403-54-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC |
| InChIKey | IESVDEZGAHUQJU-USYZEHPZSA-N |
Product Overview
1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC (CAS 59403-54-2), with molecular formula C46H80NO8P and molecular weight 805.56 g/mol. IUPAC: [(2R)-2-docosa-4,7,10,13,16,19-hexaenoyloxy-3-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC
Property Insights of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC
The XLogP value of 12.5 indicates that 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC. Following Lipinski's Rule of Five, 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC?
The CAS number of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC is 59403-54-2.
What is the molecular formula of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC?
The molecular formula of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC is C46H80NO8P.
What is the molecular weight of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC?
The molecular weight of 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC is 805.56 g/mol.
Where can I buy 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC?
You can request a quote for 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC?
Yes, KEHONG BIO provides custom synthesis services for 1-Palmitoyl-2-Docosahexaenoyl-sn-glycero-3-PC and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.