1-Stearoyl-2-arachidonoyl phosphatidylinositol
TL;DR: 1-Stearoyl-2-arachidonoyl phosphatidylinositol (CAS 88587-98-8) is a chemical compound with molecular formula C47H83O13P and molecular weight 886.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-1-[hydroxy-[(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-octadecanoyloxypropan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
Also Known As: 1-Sapit, 1-Stearoyl-2-arachidonoyl phosphatidylinositol, J3.639.299A, [(2R)-1-[hydroxy-[(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-octadecanoyloxypropan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate, myo-Inositol, 1-(2-((1-oxo-5,8,11,14-eicotetraenyl)oxy)-3-((1-oxooctadecyl)oxy)propyl hydrogen phosphate), (R-(all-Z))-
| Molecular Formula | C47H83O13P |
|---|---|
| Molecular Weight | 886.56 g/mol |
| LogP | 9.1689 |
| Topological Polar Surface Area | 209.51 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 38 |
| Exact Mass | 886.5571 |
| Heavy Atoms | 61 |
| Complexity | 1254.8761 |
Chemical Identifiers
| CAS Number | 88587-98-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC1[C@H]([C@H](C([C@H]([C@@H]1O)O)O)O)O)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
Product Overview
1-Stearoyl-2-arachidonoyl phosphatidylinositol (CAS 88587-98-8), with molecular formula C47H83O13P and molecular weight 886.56 g/mol. IUPAC: [(2R)-1-[hydroxy-[(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-octadecanoyloxypropan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate.
Chemical Property Profile of 1-Stearoyl-2-arachidonoyl phosphatidylinositol
Property Insights of 1-Stearoyl-2-arachidonoyl phosphatidylinositol
The XLogP value of 9.1689 indicates that 1-Stearoyl-2-arachidonoyl phosphatidylinositol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 209.51 Ų indicates high polarity, suggesting 1-Stearoyl-2-arachidonoyl phosphatidylinositol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Stearoyl-2-arachidonoyl phosphatidylinositol has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Stearoyl-2-arachidonoyl phosphatidylinositol?
The CAS number of 1-Stearoyl-2-arachidonoyl phosphatidylinositol is 88587-98-8.
What is the molecular formula of 1-Stearoyl-2-arachidonoyl phosphatidylinositol?
The molecular formula of 1-Stearoyl-2-arachidonoyl phosphatidylinositol is C47H83O13P.
What is the molecular weight of 1-Stearoyl-2-arachidonoyl phosphatidylinositol?
The molecular weight of 1-Stearoyl-2-arachidonoyl phosphatidylinositol is 886.56 g/mol.
Where can I buy 1-Stearoyl-2-arachidonoyl phosphatidylinositol?
You can request a quote for 1-Stearoyl-2-arachidonoyl phosphatidylinositol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Stearoyl-2-arachidonoyl phosphatidylinositol?
Yes, KEHONG BIO provides custom synthesis services for 1-Stearoyl-2-arachidonoyl phosphatidylinositol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.