Palmitylpterosin A
TL;DR: Palmitylpterosin A (CAS 39815-58-2) is a chemical compound with molecular formula C31H50O4 and molecular weight 486.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(hydroxymethyl)-2,4,6-trimethyl-3-oxo-1H-inden-5-yl]ethyl hexadecanoate
Also Known As: Palmitylpterosin A, Hexadecanoic acid, 2-(2,3-dihydro-2-(hydroxymethyl)-2,4,6-trimethyl-3-oxo-1H-inden-5-yl)ethyl ester, (-)-, 2-[2-(hydroxymethyl)-2,4,6-trimethyl-3-oxo-1H-inden-5-yl]ethyl hexadecanoate, 2-[2-(Hydroxymethyl)-2,4,6-trimethyl-3-oxo-2,3-dihydro-1H-inden-5-yl]ethyl hexadecanoate
| Molecular Formula | C31H50O4 |
|---|---|
| Molecular Weight | 486.37 g/mol |
| LogP | 10.1 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 19 |
| Exact Mass | 486.3709 |
| Heavy Atoms | 35 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 39815-58-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCCC1=C(C2=C(CC(C2=O)(C)CO)C=C1C)C |
| InChIKey | IUVSSTAUCDMBMO-UHFFFAOYSA-N |
Product Overview
Palmitylpterosin A (CAS 39815-58-2), with molecular formula C31H50O4 and molecular weight 486.37 g/mol. IUPAC: 2-[2-(hydroxymethyl)-2,4,6-trimethyl-3-oxo-1H-inden-5-yl]ethyl hexadecanoate.
Chemical Property Profile of Palmitylpterosin A
Property Insights of Palmitylpterosin A
The XLogP value of 10.1 indicates that Palmitylpterosin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Palmitylpterosin A. Following Lipinski's Rule of Five, Palmitylpterosin A has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Palmitylpterosin A?
The CAS number of Palmitylpterosin A is 39815-58-2.
What is the molecular formula of Palmitylpterosin A?
The molecular formula of Palmitylpterosin A is C31H50O4.
What is the molecular weight of Palmitylpterosin A?
The molecular weight of Palmitylpterosin A is 486.37 g/mol.
Where can I buy Palmitylpterosin A?
You can request a quote for Palmitylpterosin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Palmitylpterosin A?
Yes, KEHONG BIO provides custom synthesis services for Palmitylpterosin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.