Products 1014699-64-9
CAS 1014699-64-9 is the registry number for Ketoprofen-CoA. Offered by: MedChemExpress. Available pack sizes: Get quote.
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-(3-benzoylphenyl)propanethioate (CAS 1014699-64-9) is a chemical compound with the molecular formula C37H48N7O18P3S and a molecular weight of 1003.8 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] 2-(3-benzoylphenyl)propanethioate. InChIKey: LSGSFYULVWAIJK-UTQRSAMOSA-N.
| Molecular formula | C37H48N7O18P3S |
|---|---|
| Molecular weight | 1003.8 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] 2-(3-benzoylphenyl)propanethioate |
| InChIKey | LSGSFYULVWAIJK-UTQRSAMOSA-N |
| SMILES | CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)OP(=O)(O)O)O |
Computed by PubChem (NCBI)
Synonyms:
orb3145306