Products 2484728-87-0
CAS 2484728-87-0 is the registry number for 3,5,7-Trioxododecanoyl-CoA. Offered by: MedChemExpress. Available pack sizes: Get quote.
3,5,7-trioxododecanoyl-CoA is an oxo fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3,5,7-trioxododecanoic acid. It is a 3-oxo-fatty acyl-CoA and a medium-chain fatty acyl-CoA. It is a conjugate acid of a 3,5,7-trioxododecanoyl-CoA(4-).
Source: ChEBI
| Molecular formula | C33H52N7O20P3S |
|---|---|
| Molecular weight | 991.8 g/mol |
| IUPAC name | 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] 3,5,7-trioxododecanethioate |
| InChIKey | VHFNTMSJVWRHBO-GMHMEAMDSA-N |
| SMILES | CCCCCC(=O)CC(=O)CC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(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)O |
Computed by PubChem (NCBI)