3-O-(1-Hexadecyl)cholesterol
TL;DR: 3-O-(1-Hexadecyl)cholesterol (CAS 22032-48-0) is a chemical compound with molecular formula C43H78O and molecular weight 610.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8S,9S,10R,13R,14S,17R)-3-hexadecoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
Also Known As: Cholesterylhexadecyl ether, Hexadecyl cholesteryl ether, 3-O-(1-Hexadecyl)cholesterol, cholesterol hexadecyl ether, 3-(Hexadecyloxy)cholest-5-ene
| Molecular Formula | C43H78O |
|---|---|
| Molecular Weight | 610.61 g/mol |
| LogP | 13.8943 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 21 |
| Exact Mass | 610.6053 |
| Heavy Atoms | 44 |
| Complexity | 826.7806 |
Chemical Identifiers
| CAS Number | 22032-48-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCO[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C |
Product Overview
3-O-(1-Hexadecyl)cholesterol (CAS 22032-48-0), with molecular formula C43H78O and molecular weight 610.61 g/mol. IUPAC: (3S,8S,9S,10R,13R,14S,17R)-3-hexadecoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene.
Chemical Property Profile of 3-O-(1-Hexadecyl)cholesterol
Property Insights of 3-O-(1-Hexadecyl)cholesterol
The XLogP value of 13.8943 indicates that 3-O-(1-Hexadecyl)cholesterol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 3-O-(1-Hexadecyl)cholesterol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-O-(1-Hexadecyl)cholesterol has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-O-(1-Hexadecyl)cholesterol?
The CAS number of 3-O-(1-Hexadecyl)cholesterol is 22032-48-0.
What is the molecular formula of 3-O-(1-Hexadecyl)cholesterol?
The molecular formula of 3-O-(1-Hexadecyl)cholesterol is C43H78O.
What is the molecular weight of 3-O-(1-Hexadecyl)cholesterol?
The molecular weight of 3-O-(1-Hexadecyl)cholesterol is 610.61 g/mol.
Where can I buy 3-O-(1-Hexadecyl)cholesterol?
You can request a quote for 3-O-(1-Hexadecyl)cholesterol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-O-(1-Hexadecyl)cholesterol?
Yes, KEHONG BIO provides custom synthesis services for 3-O-(1-Hexadecyl)cholesterol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.