1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate
TL;DR: 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate (CAS 70560-94-0) is a chemical compound with molecular formula C37H71O8P and molecular weight 674.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,3R)-3-hexadecanoyloxy-2-phosphonooxycyclopentyl] hexadecanoate
Also Known As: Sid 769360, KST-1A8830, 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate, cis-1,3-Diacylcyclopentane-1,2,3-triol-2-phosphate, (1r,3s)-2-(phosphonooxy)cyclopentane-1,3-diyl dihexadecanoate
| Molecular Formula | C37H71O8P |
|---|---|
| Molecular Weight | 674.49 g/mol |
| LogP | 13.6 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 34 |
| Exact Mass | 674.48865 |
| Heavy Atoms | 46 |
| Complexity | 733.0 |
Chemical Identifiers
| CAS Number | 70560-94-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)O[C@@H]1CC[C@@H](C1OP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | NHHRIBNIXVBAMI-DURGVPNOSA-N |
Product Overview
1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate (CAS 70560-94-0), with molecular formula C37H71O8P and molecular weight 674.49 g/mol. IUPAC: [(1S,3R)-3-hexadecanoyloxy-2-phosphonooxycyclopentyl] hexadecanoate.
Chemical Property Profile of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate
Property Insights of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate
The XLogP value of 13.6 indicates that 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate. Following Lipinski's Rule of Five, 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate?
The CAS number of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate is 70560-94-0.
What is the molecular formula of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate?
The molecular formula of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate is C37H71O8P.
What is the molecular weight of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate?
The molecular weight of 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate is 674.49 g/mol.
Where can I buy 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate?
You can request a quote for 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dipalmitoylcyclopentane-1,2,3,-triol-2-phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.