Products 1176732-42-5
CAS 1176732-42-5 is the registry number for Propylmalonyl-CoA. Offered by: MedChemExpress. Available pack sizes: Get quote.
2-[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]ethylsulfanylcarbonyl]pentanoic acid (CAS 1176732-42-5) is a chemical compound with the molecular formula C27H44N7O19P3S and a molecular weight of 895.7 g/mol. IUPAC name: 2-[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]ethylsulfanylcarbonyl]pentanoic acid. InChIKey: KIJUWBPJFSIWKM-XGXNYEOVSA-N.
| Molecular formula | C27H44N7O19P3S |
|---|---|
| Molecular weight | 895.7 g/mol |
| IUPAC name | 2-[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]ethylsulfanylcarbonyl]pentanoic acid |
| InChIKey | KIJUWBPJFSIWKM-XGXNYEOVSA-N |
| SMILES | CCCC(C(=O)O)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)