Trehalose 6,6'-dipalmitate
TL;DR: Trehalose 6,6'-dipalmitate (CAS 38053-91-7) is a chemical compound with molecular formula C44H82O13 and molecular weight 818.58 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5S,6R)-6-(hexadecanoyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate
Also Known As: Trehalose 6,6'-dipalmitate, trehalose6,6'-dipalmitate, 6,6'-di-O-palmitoyltrehalose, [(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5S,6R)-6-(hexadecanoyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate, 6-o-hexadecanoyl-
| Molecular Formula | C44H82O13 |
|---|---|
| Molecular Weight | 818.58 g/mol |
| LogP | 10.5 |
| Topological Polar Surface Area | 202.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 36 |
| Exact Mass | 818.57556 |
| Heavy Atoms | 57 |
| Complexity | 925.0 |
Chemical Identifiers
| CAS Number | 38053-91-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)CCCCCCCCCCCCCCC)O)O)O)O)O)O |
| InChIKey | MLBQQWHGQOOQRB-MWHATQTKSA-N |
Product Overview
Trehalose 6,6'-dipalmitate (CAS 38053-91-7), with molecular formula C44H82O13 and molecular weight 818.58 g/mol. IUPAC: [(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5S,6R)-6-(hexadecanoyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate.
Chemical Property Profile of Trehalose 6,6'-dipalmitate
Property Insights of Trehalose 6,6'-dipalmitate
The XLogP value of 10.5 indicates that Trehalose 6,6'-dipalmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 202.0 Ų indicates high polarity, suggesting Trehalose 6,6'-dipalmitate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trehalose 6,6'-dipalmitate has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trehalose 6,6'-dipalmitate?
The CAS number of Trehalose 6,6'-dipalmitate is 38053-91-7.
What is the molecular formula of Trehalose 6,6'-dipalmitate?
The molecular formula of Trehalose 6,6'-dipalmitate is C44H82O13.
What is the molecular weight of Trehalose 6,6'-dipalmitate?
The molecular weight of Trehalose 6,6'-dipalmitate is 818.58 g/mol.
Where can I buy Trehalose 6,6'-dipalmitate?
You can request a quote for Trehalose 6,6'-dipalmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trehalose 6,6'-dipalmitate?
Yes, KEHONG BIO provides custom synthesis services for Trehalose 6,6'-dipalmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.