Ademetionine
TL;DR: Ademetionine (CAS 17176-17-9) is a chemical compound with molecular formula C15H22N6O5S and molecular weight 398.14 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-methylsulfonio]butanoate
Also Known As: Ademetionine, S-adenosylmethionine, S-adenosyl-L-methionine, S-Adenosyl-L-Methtonine, S-Adenosyl-DL-methionine
| Molecular Formula | C15H22N6O5S |
|---|---|
| Molecular Weight | 398.14 g/mol |
| LogP | -2.8 |
| Topological Polar Surface Area | 186.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.13724 |
| Heavy Atoms | 27 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 17176-17-9 |
|---|---|
| SMILES | C[S+](CCC(C(=O)[O-])N)CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | MEFKEPWMEQBLKI-UHFFFAOYSA-N |
Product Overview
Ademetionine (CAS 17176-17-9), with molecular formula C15H22N6O5S and molecular weight 398.14 g/mol. IUPAC: 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl-methylsulfonio]butanoate.
Chemical Property Profile of Ademetionine
Property Insights of Ademetionine
The XLogP value of -2.8 indicates that Ademetionine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 186.0 Ų indicates high polarity, suggesting Ademetionine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ademetionine 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 Ademetionine?
The CAS number of Ademetionine is 17176-17-9.
What is the molecular formula of Ademetionine?
The molecular formula of Ademetionine is C15H22N6O5S.
What is the molecular weight of Ademetionine?
The molecular weight of Ademetionine is 398.14 g/mol.
Where can I buy Ademetionine?
You can request a quote for Ademetionine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ademetionine?
Yes, KEHONG BIO provides custom synthesis services for Ademetionine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.