O-Palmitoylpullulan
TL;DR: O-Palmitoylpullulan (CAS 53572-58-0) is a chemical compound with molecular formula C40H72O22 and molecular weight 904.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R,6S)-4,5-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-2-yl]methyl hexadecanoate
Also Known As: O-Palmitoylpullulan, Pullulan palmitate, Pullulan, hexadecanoate, [(2R,3R,4S,5R,6S)-4,5-dihydroxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-oxan-2-yl]methoxy]oxan-2-yl]methyl hexadecanoate, [(2R,3S,4R,5R,6S)-4,5-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-2-yl]methyl hexadecanoate
| Molecular Formula | C40H72O22 |
|---|---|
| Molecular Weight | 904.45 g/mol |
| LogP | -3.7166 |
| Topological Polar Surface Area | 353.9 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 25 |
| Exact Mass | 904.45154 |
| Heavy Atoms | 62 |
| Complexity | 1250.511 |
Chemical Identifiers
| CAS Number | 53572-58-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O)CO)O)O)O)O)O)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
Product Overview
O-Palmitoylpullulan (CAS 53572-58-0), with molecular formula C40H72O22 and molecular weight 904.45 g/mol. IUPAC: [(2R,3S,4R,5R,6S)-4,5-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-2-yl]methyl hexadecanoate.
Chemical Property Profile of O-Palmitoylpullulan
Property Insights of O-Palmitoylpullulan
The XLogP value of -3.7166 indicates that O-Palmitoylpullulan is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 353.9 Ų indicates high polarity, suggesting O-Palmitoylpullulan may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, O-Palmitoylpullulan has 13 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 O-Palmitoylpullulan?
The CAS number of O-Palmitoylpullulan is 53572-58-0.
What is the molecular formula of O-Palmitoylpullulan?
The molecular formula of O-Palmitoylpullulan is C40H72O22.
What is the molecular weight of O-Palmitoylpullulan?
The molecular weight of O-Palmitoylpullulan is 904.45 g/mol.
Where can I buy O-Palmitoylpullulan?
You can request a quote for O-Palmitoylpullulan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Palmitoylpullulan?
Yes, KEHONG BIO provides custom synthesis services for O-Palmitoylpullulan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.