Adenosylselenomethionine
TL;DR: Adenosylselenomethionine (CAS 5458-67-3) is a chemical compound with molecular formula C15H22N6O5Se and molecular weight 446.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl-methylselaniumyl]butanoate
Also Known As: Adosemet, Adenosylselenomethionine, 2-Norpinene,3,6,6-trimethyl, 3,6,6-trimethylbicyclo[3.1.1]hept-3-ene, 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl-methylselaniumyl]butanoate
| Molecular Formula | C15H22N6O5Se |
|---|---|
| Molecular Weight | 446.08 g/mol |
| LogP | -2.3804 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.0817 |
| Heavy Atoms | 27 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 5458-67-3 |
|---|---|
| SMILES | C[Se+](CCC(C(=O)[O-])N)CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | GGJFWMOVUFBSIN-UHFFFAOYSA-N |
Product Overview
Adenosylselenomethionine (CAS 5458-67-3), with molecular formula C15H22N6O5Se and molecular weight 446.08 g/mol. IUPAC: 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl-methylselaniumyl]butanoate.
Chemical Property Profile of Adenosylselenomethionine
Property Insights of Adenosylselenomethionine
The XLogP value of -2.3804 indicates that Adenosylselenomethionine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 185.0 Ų indicates high polarity, suggesting Adenosylselenomethionine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosylselenomethionine has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adenosylselenomethionine?
The CAS number of Adenosylselenomethionine is 5458-67-3.
What is the molecular formula of Adenosylselenomethionine?
The molecular formula of Adenosylselenomethionine is C15H22N6O5Se.
What is the molecular weight of Adenosylselenomethionine?
The molecular weight of Adenosylselenomethionine is 446.08 g/mol.
Where can I buy Adenosylselenomethionine?
You can request a quote for Adenosylselenomethionine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adenosylselenomethionine?
Yes, KEHONG BIO provides custom synthesis services for Adenosylselenomethionine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.