![4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ structure](/static/products/2771/27718-41-8.webp)
4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+
TL;DR: 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ (CAS 27718-41-8) is a chemical compound with molecular formula C28H40N7O18P3S and molecular weight 887.13635 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-hydroxybenzenecarbothioate
Also Known As: 4-Hydroxybenzoyl-coenzyme A, Coenzyme A, S-(4-hydroxybenzoate), 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+;, S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-hydroxybenzenecarbothioate
Technical Specifications
| Molecular Formula | C28H40N7O18P3S |
| Molecular Weight | 887.13635 g/mol |
| XLogP | -4.3 |
| Topological Polar Surface Area (TPSA) | 409.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 21 |
| Exact Mass | 887.13635 Da |
| Heavy Atoms | 57 |
| Complexity | 1540.0 |
| SMILES | CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)C4=CC=C(C=C4)O)O |
| InChIKey | LTVXPVBFJBTNIJ-UHFFFAOYSA-N |
Product Description
Applications: 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ (CAS 27718-41-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ (CAS 27718-41-8) has the molecular formula C28H40N7O18P3S and a molecular weight of 887.14 g/mol. It is also known as 4-Hydroxybenzoyl-coenzyme A and Coenzyme A, S-(4-hydroxybenzoate).
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+
Property Insights of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+
The XLogP value of -4.3 indicates that 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 409.0 Ų indicates high polarity, suggesting 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ has 10 hydrogen bond donor(s) and 23 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+?
The CAS number of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ is 27718-41-8.
What is the molecular formula of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+?
The molecular formula of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ is C28H40N7O18P3S.
What is the molecular weight of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+?
The molecular weight of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ is 887.13635 g/mol.
What are the applications of 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+?
4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ (CAS 27718-41-8) with custom synthesis available from...
Where can I buy 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+?
You can request a quote for 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+?
Yes, CoreyChem provides custom synthesis services for 4-Hydroxybenzoyl-coenzyme A; (Acyl-CoA); [M+H]+ and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.