Melitin
TL;DR: Melitin (CAS 81944-31-2) is a chemical compound with molecular formula C39H50O24 and molecular weight 902.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
Also Known As: Melitin, Melitine, Brucella melitensis M antigen, M Antigen, Brucella Melitensis, M Antigen (brucella melitensis)
| Molecular Formula | C39H50O24 |
|---|---|
| Molecular Weight | 902.27 g/mol |
| LogP | -5.0678 |
| Topological Polar Surface Area | 387.27 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 11 |
| Exact Mass | 902.2692 |
| Heavy Atoms | 63 |
| Complexity | 2083.3884 |
Chemical Identifiers
| CAS Number | 81944-31-2 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2C(C(OC(C2O)OC3=CC(=C4C(=C3)OC(=C(C4=O)OC5C(C(C(C(O5)COC6C(C(C(C(O6)CO)O)O)O)O)O)O)C7=CC=C(C=C7)O)O)C)O)O)O)O |
Product Overview
Melitin (CAS 81944-31-2), with molecular formula C39H50O24 and molecular weight 902.27 g/mol. IUPAC: 7-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Melitin
Property Insights of Melitin
The XLogP value of -5.0678 indicates that Melitin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 387.27 Ų indicates high polarity, suggesting Melitin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Melitin has 14 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Melitin?
The CAS number of Melitin is 81944-31-2.
What is the molecular formula of Melitin?
The molecular formula of Melitin is C39H50O24.
What is the molecular weight of Melitin?
The molecular weight of Melitin is 902.27 g/mol.
Where can I buy Melitin?
You can request a quote for Melitin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Melitin?
Yes, KEHONG BIO provides custom synthesis services for Melitin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.