Products 319440-43-2
CAS 319440-43-2 is the registry number for S-[(2S)-3-Hydroxy-2-methylpropanoate]-CoA. Offered by: MedChemExpress. Available pack sizes: Get quote.
(S)-3-hydroxyisobutyryl-CoA is a hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxyisobutyric acid. It has a role as a mouse metabolite and a human metabolite. It is a 3-hydroxy fatty acyl-CoA and a hydroxy fatty acyl-CoA. It is functionally related to an isobutyryl-CoA and a (S)-3-hydroxyisobutyric acid. It is a conjugate acid of a (S)-3-hydroxyisobutyryl-CoA(4-).
Source: ChEBI
| Molecular formula | C25H42N7O18P3S |
|---|---|
| Molecular weight | 853.6 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] (2S)-3-hydroxy-2-methylpropanethioate |
| InChIKey | WWEOGFZEFHPUAM-UQCJFRAESA-N |
| SMILES | C[C@@H](CO)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)
Synonyms:
(S)-3-Hydroxyisobutyryl-CoA, (S)-3-hydroxyisobutanoyl-CoA, (S)-3-hydroxyisobutyryl-coenzyme A, (S)-3-hydroxyisobutanoyl-coenzyme A, Coenzyme A,S-[(2S)-3-hydroxy-2-methylpropanoate] (9CI), (S)-3-hydroxy-2-methylpropanoyl-coenzyme A, (S)-3-hydroxy-2-methylpropionyl-coenzyme A, (S)-3-hydroxy-2-methylpropanoyl-CoA, orb3145217, Coenzyme A, S-[(2S)-3-hydroxy-2-methylpropanoate]