酰基肉碱
TL;DR: 酰基肉碱 (CAS 485-80-3) is a chemical compound with molecular formula C15H23N6O5S+ and molecular weight 399.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
酰基肉碱
(3-amino-3-carboxypropyl)-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium
Also Known As: Acylcarnitine, S-adenosylmethionine, S-adenosyl-L-methionine, Ademetionine disulfate tosylate, S-(5'-Adenosyl)-L-methionine
| Molecular Formula | C15H23N6O5S+ |
|---|---|
| Molecular Weight | 399.15 g/mol |
| LogP | -3.5 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.14505 |
| Heavy Atoms | 27 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 485-80-3 |
|---|---|
| SMILES | C[S+](CCC(C(=O)O)N)CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | MEFKEPWMEQBLKI-UHFFFAOYSA-O |
Product Overview
酰基肉碱 (CAS 485-80-3), with molecular formula C15H23N6O5S+ and molecular weight 399.15 g/mol. IUPAC: (3-amino-3-carboxypropyl)-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium.
Chemical Property Profile of 酰基肉碱
Property Insights of 酰基肉碱
The XLogP value of -3.5 indicates that 酰基肉碱 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 184.0 Ų indicates high polarity, suggesting 酰基肉碱 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 酰基肉碱 has 5 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 酰基肉碱?
The CAS number of 酰基肉碱 is 485-80-3.
What is the molecular formula of 酰基肉碱?
The molecular formula of 酰基肉碱 is C15H23N6O5S+.
What is the molecular weight of 酰基肉碱?
The molecular weight of 酰基肉碱 is 399.15 g/mol.
Where can I buy 酰基肉碱?
You can request a quote for 酰基肉碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 酰基肉碱?
Yes, KEHONG BIO provides custom synthesis services for 酰基肉碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.