C16 Sulfatide
TL;DR: C16 Sulfatide (CAS 89771-78-8) is a chemical compound with molecular formula C40H77NO11S and molecular weight 779.52 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4S,5S,6R)-2-[(E,2S,3R)-2-(hexadecanoylamino)-3-hydroxyoctadec-4-enoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfate
Also Known As: C16 Sulfatide, Palmitoyl Sulfatide, sulfatide C16:0, N-Palmitoylsulphatide, Epitope ID:139425
| Molecular Formula | C40H77NO11S |
|---|---|
| Molecular Weight | 779.52 g/mol |
| LogP | 7.2143 |
| Topological Polar Surface Area | 192.08 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 35 |
| Exact Mass | 779.5217 |
| Heavy Atoms | 53 |
| Complexity | 1014.64624 |
Chemical Identifiers
| CAS Number | 89771-78-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)OS(=O)(=O)O)O)[C@@H](/C=C/CCCCCCCCCCCCC)O |
Product Overview
C16 Sulfatide (CAS 89771-78-8), with molecular formula C40H77NO11S and molecular weight 779.52 g/mol. IUPAC: [(2R,3R,4S,5S,6R)-2-[(E,2S,3R)-2-(hexadecanoylamino)-3-hydroxyoctadec-4-enoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfate.
Chemical Property Profile of C16 Sulfatide
Property Insights of C16 Sulfatide
The XLogP value of 7.2143 indicates that C16 Sulfatide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 192.08 Ų indicates high polarity, suggesting C16 Sulfatide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C16 Sulfatide has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C16 Sulfatide?
The CAS number of C16 Sulfatide is 89771-78-8.
What is the molecular formula of C16 Sulfatide?
The molecular formula of C16 Sulfatide is C40H77NO11S.
What is the molecular weight of C16 Sulfatide?
The molecular weight of C16 Sulfatide is 779.52 g/mol.
Where can I buy C16 Sulfatide?
You can request a quote for C16 Sulfatide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C16 Sulfatide?
Yes, KEHONG BIO provides custom synthesis services for C16 Sulfatide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.