11-deoxy-16,16-trimethyleneprostaglandin E1
TL;DR: 11-deoxy-16,16-trimethyleneprostaglandin E1 (CAS 62407-92-5) is a chemical compound with molecular formula C23H38O4 and molecular weight 378.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(1R,2R)-2-[(E,3S)-3-(1-butylcyclobutyl)-3-hydroxyprop-1-enyl]-5-oxocyclopentyl]heptanoic acid
Also Known As: Cid 6443580, 11-Deoxy-16,16-trimethyleneprostaglandin E1, 7-[(1R,2R)-2-[(E,3S)-3-(1-butylcyclobutyl)-3-hydroxyprop-1-enyl]-5-oxocyclopentyl]heptanoic acid, Cyclopentaneheptanoic acid, 2-(3-(1-butylcyclobutyl)-3-hydroxy-1-propenyl)-5-oxo-, (1alpha,2beta(1E,3S*))-(+-)-, RefChem:77829
| Molecular Formula | C23H38O4 |
|---|---|
| Molecular Weight | 378.28 g/mol |
| LogP | 5.2845 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 378.277 |
| Heavy Atoms | 27 |
| Complexity | 506.50775 |
Chemical Identifiers
| CAS Number | 62407-92-5 |
|---|---|
| SMILES | CCCCC1(CCC1)[C@H](/C=C/[C@H]2CCC(=O)[C@@H]2CCCCCCC(=O)O)O |
Product Overview
11-deoxy-16,16-trimethyleneprostaglandin E1 (CAS 62407-92-5), with molecular formula C23H38O4 and molecular weight 378.28 g/mol. IUPAC: 7-[(1R,2R)-2-[(E,3S)-3-(1-butylcyclobutyl)-3-hydroxyprop-1-enyl]-5-oxocyclopentyl]heptanoic acid.
Chemical Property Profile of 11-deoxy-16,16-trimethyleneprostaglandin E1
Property Insights of 11-deoxy-16,16-trimethyleneprostaglandin E1
The XLogP value of 5.2845 indicates that 11-deoxy-16,16-trimethyleneprostaglandin E1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-deoxy-16,16-trimethyleneprostaglandin E1. Following Lipinski's Rule of Five, 11-deoxy-16,16-trimethyleneprostaglandin E1 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11-deoxy-16,16-trimethyleneprostaglandin E1?
The CAS number of 11-deoxy-16,16-trimethyleneprostaglandin E1 is 62407-92-5.
What is the molecular formula of 11-deoxy-16,16-trimethyleneprostaglandin E1?
The molecular formula of 11-deoxy-16,16-trimethyleneprostaglandin E1 is C23H38O4.
What is the molecular weight of 11-deoxy-16,16-trimethyleneprostaglandin E1?
The molecular weight of 11-deoxy-16,16-trimethyleneprostaglandin E1 is 378.28 g/mol.
Where can I buy 11-deoxy-16,16-trimethyleneprostaglandin E1?
You can request a quote for 11-deoxy-16,16-trimethyleneprostaglandin E1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-deoxy-16,16-trimethyleneprostaglandin E1?
Yes, KEHONG BIO provides custom synthesis services for 11-deoxy-16,16-trimethyleneprostaglandin E1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.