Products 198691-16-6
CAS 198691-16-6 is the registry number for 1-Carboxyethyl-CoA. Offered by: MedChemExpress. Available pack sizes: Get quote.
2-[2-[3-[[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]ethylsulfanyl]propanoic acid (CAS 198691-16-6) is a chemical compound with the molecular formula C24H40N7O18P3S and a molecular weight of 839.6 g/mol. IUPAC name: 2-[2-[3-[[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]ethylsulfanyl]propanoic acid. InChIKey: ULCSPOREAVNZTJ-RVTPZZGCSA-N.
| Molecular formula | C24H40N7O18P3S |
|---|---|
| Molecular weight | 839.6 g/mol |
| IUPAC name | 2-[2-[3-[[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]ethylsulfanyl]propanoic acid |
| InChIKey | ULCSPOREAVNZTJ-RVTPZZGCSA-N |
| SMILES | CC(C(=O)O)SCCNC(=O)CCNC(=O)C(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:
1-Carboxyethyl-CoA