Erucylcarnitine
TL;DR: Erucylcarnitine (CAS 36168-22-6) is a chemical compound with molecular formula C29H55NO4 and molecular weight 481.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(Z)-docos-13-enoyl]oxy-4-(trimethylazaniumyl)butanoate
Also Known As: Erucylcarnitine, Erucoylcarnitine, (+/-)-erucylcarnitine, ERUCYLCARNITINE, (A+-)-, ERUCYLCARNITINE, (+/-)-
| Molecular Formula | C29H55NO4 |
|---|---|
| Molecular Weight | 481.41 g/mol |
| LogP | 6.3423 |
| Topological Polar Surface Area | 66.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 24 |
| Exact Mass | 481.41312 |
| Heavy Atoms | 34 |
| Complexity | 524.71387 |
Chemical Identifiers
| CAS Number | 36168-22-6 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C |
Product Overview
Erucylcarnitine (CAS 36168-22-6), with molecular formula C29H55NO4 and molecular weight 481.41 g/mol. IUPAC: 3-[(Z)-docos-13-enoyl]oxy-4-(trimethylazaniumyl)butanoate.
Chemical Property Profile of Erucylcarnitine
Property Insights of Erucylcarnitine
The XLogP value of 6.3423 indicates that Erucylcarnitine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Erucylcarnitine. Following Lipinski's Rule of Five, Erucylcarnitine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Erucylcarnitine?
The CAS number of Erucylcarnitine is 36168-22-6.
What is the molecular formula of Erucylcarnitine?
The molecular formula of Erucylcarnitine is C29H55NO4.
What is the molecular weight of Erucylcarnitine?
The molecular weight of Erucylcarnitine is 481.41 g/mol.
Where can I buy Erucylcarnitine?
You can request a quote for Erucylcarnitine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Erucylcarnitine?
Yes, KEHONG BIO provides custom synthesis services for Erucylcarnitine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.