![c1105; (Acyl-CoA); [M+H]+ structure](/static/products/137/1379003-99-2.png)
c1105; (Acyl-CoA); [M+H]+
TL;DR: c1105; (Acyl-CoA); [M+H]+ (CAS 1379003-99-2) is a chemical compound with molecular formula C26H38N7O18P3S2 and molecular weight 893.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-oxo-3H-thiophene-5-carbothioate
Also Known As: c1105, c1105; (Acyl-CoA); [M+H]+;, 5-Oxo-4,5-dihydrothiophene-2-carboxyl-CoA
| Molecular Formula | C26H38N7O18P3S2 |
|---|---|
| Molecular Weight | 893.09 g/mol |
| LogP | -0.7879 |
| Topological Polar Surface Area | 380.7 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 20 |
| Exact Mass | 893.0928 |
| Heavy Atoms | 56 |
| Complexity | 1981.0645 |
Chemical Identifiers
| CAS Number | 1379003-99-2 |
|---|---|
| SMILES | CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)C4=CCC(=O)S4)O |
Product Overview
c1105; (Acyl-CoA); [M+H]+ (CAS 1379003-99-2), with molecular formula C26H38N7O18P3S2 and molecular weight 893.09 g/mol. IUPAC: S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-oxo-3H-thiophene-5-carbothioate.
Chemical Property Profile of c1105; (Acyl-CoA); [M+H]+
Property Insights of c1105; (Acyl-CoA); [M+H]+
The XLogP value of -0.7879 indicates that c1105; (Acyl-CoA); [M+H]+ is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 380.7 Ų indicates high polarity, suggesting c1105; (Acyl-CoA); [M+H]+ may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, c1105; (Acyl-CoA); [M+H]+ has 9 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of c1105; (Acyl-CoA); [M+H]+?
The CAS number of c1105; (Acyl-CoA); [M+H]+ is 1379003-99-2.
What is the molecular formula of c1105; (Acyl-CoA); [M+H]+?
The molecular formula of c1105; (Acyl-CoA); [M+H]+ is C26H38N7O18P3S2.
What is the molecular weight of c1105; (Acyl-CoA); [M+H]+?
The molecular weight of c1105; (Acyl-CoA); [M+H]+ is 893.09 g/mol.
Where can I buy c1105; (Acyl-CoA); [M+H]+?
You can request a quote for c1105; (Acyl-CoA); [M+H]+ directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for c1105; (Acyl-CoA); [M+H]+?
Yes, KEHONG BIO provides custom synthesis services for c1105; (Acyl-CoA); [M+H]+ and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.