Monoerucin
TL;DR: Monoerucin (CAS 17331-71-4) is a chemical compound with molecular formula C25H48O4 and molecular weight 412.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydroxypropyl (E)-docos-13-enoate
Also Known As: Monoerucin, 2,3-Dihydroxypropyl erucate, Isorhamnetin 3-glucoside-7-rhamnoside, 1-(cis-13-Docosenoyl)-rac-glycerol, 2,3-dihydroxypropyl docos-13-enoate
| Molecular Formula | C25H48O4 |
|---|---|
| Molecular Weight | 412.36 g/mol |
| LogP | 6.4807 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 22 |
| Exact Mass | 412.35526 |
| Heavy Atoms | 29 |
| Complexity | 367.83487 |
Chemical Identifiers
| CAS Number | 17331-71-4 |
|---|---|
| SMILES | CCCCCCCC/C=C/CCCCCCCCCCCC(=O)OCC(CO)O |
Product Overview
Monoerucin (CAS 17331-71-4), with molecular formula C25H48O4 and molecular weight 412.36 g/mol. IUPAC: 2,3-dihydroxypropyl (E)-docos-13-enoate.
Chemical Property Profile of Monoerucin
Property Insights of Monoerucin
The XLogP value of 6.4807 indicates that Monoerucin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Monoerucin. Following Lipinski's Rule of Five, Monoerucin has 2 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 Monoerucin?
The CAS number of Monoerucin is 17331-71-4.
What is the molecular formula of Monoerucin?
The molecular formula of Monoerucin is C25H48O4.
What is the molecular weight of Monoerucin?
The molecular weight of Monoerucin is 412.36 g/mol.
Where can I buy Monoerucin?
You can request a quote for Monoerucin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Monoerucin?
Yes, KEHONG BIO provides custom synthesis services for Monoerucin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.