(3R)-3-hydroxyoctanoyl-CoA
TL;DR: (3R)-3-hydroxyoctanoyl-CoA (CAS 117249-49-7) is a chemical compound with molecular formula C29H50N7O18P3S and molecular weight 909.2146 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] 3-hydroxyoctanethioate
Also Known As: (3R)-3-hydroxyoctanoyl-CoA, 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] 3-hydroxyoctanethioate
Technical Specifications
| Molecular Formula | C29H50N7O18P3S |
| Molecular Weight | 909.2146 g/mol |
| XLogP | -4.0 |
| Topological Polar Surface Area (TPSA) | 409.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 26 |
| Exact Mass | 909.2146 Da |
| Heavy Atoms | 58 |
| Complexity | 1520.0 |
| SMILES | CCCCCC(CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O)O |
| InChIKey | ATVGTMKWKDUCMS-UHFFFAOYSA-N |
Product Description
Applications: (3R)-3-hydroxyoctanoyl-CoA is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
(3R)-3-hydroxyoctanoyl-CoA is a fine chemical identified by CAS number 117249-49-7 and the molecular formula C29H50N7O18P3S and a molecular weight of 909.21 g/mol. Synonyms include (3R)-3-hydroxyoctanoyl-CoA and 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] 3-hydroxyoctanethioate.
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 (3R)-3-hydroxyoctanoyl-CoA
Property Insights of (3R)-3-hydroxyoctanoyl-CoA
The XLogP value of -4.0 indicates that (3R)-3-hydroxyoctanoyl-CoA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 409.0 Ų indicates high polarity, suggesting (3R)-3-hydroxyoctanoyl-CoA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (3R)-3-hydroxyoctanoyl-CoA 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 (3R)-3-hydroxyoctanoyl-CoA?
The CAS number of (3R)-3-hydroxyoctanoyl-CoA is 117249-49-7.
What is the molecular formula of (3R)-3-hydroxyoctanoyl-CoA?
The molecular formula of (3R)-3-hydroxyoctanoyl-CoA is C29H50N7O18P3S.
What is the molecular weight of (3R)-3-hydroxyoctanoyl-CoA?
The molecular weight of (3R)-3-hydroxyoctanoyl-CoA is 909.2146 g/mol.
What are the applications of (3R)-3-hydroxyoctanoyl-CoA?
(3R)-3-hydroxyoctanoyl-CoA is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS,...
Where can I buy (3R)-3-hydroxyoctanoyl-CoA?
You can request a quote for (3R)-3-hydroxyoctanoyl-CoA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3R)-3-hydroxyoctanoyl-CoA?
Yes, CoreyChem provides custom synthesis services for (3R)-3-hydroxyoctanoyl-CoA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.