Products 15621-60-0
CAS 15621-60-0 is the registry number for Isobutyryl-CoA, 99.0%. Offered by: MedChemExpress. Available pack sizes: Get quote.
Isobutyryl-CoA is a short-chain, methyl-branched fatty acyl-CoA that is the S-isobutyryl derivative of coenzyme A. It has a role as a mouse metabolite and a human metabolite. It is a methyl-branched fatty acyl-CoA and a short-chain fatty acyl-CoA. It is functionally related to a coenzyme A and an isobutyric acid. It is a conjugate acid of an isobutyryl-CoA(4-).
Source: ChEBI
| Molecular formula | C25H42N7O17P3S |
|---|---|
| Molecular weight | 837.6 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] 2-methylpropanethioate |
| InChIKey | AEWHYWSPVRZHCT-NDZSKPAWSA-N |
| SMILES | CC(C)C(=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)