Products 799812-87-6
CAS 799812-87-6 appears in our catalog under these names: 18：0 Coenzyme A triammonium, Stearoyl coenzyme A ammonium, 18:0 COENZYME A, stearoyl Coenzyme A (ammonium salt), 18:0 Coenzyme A (triammonium), 99.9%. Offered by: GLPBio, Biosynth, Sigma-Aldrich, Chemat, MedChemExpress. Available pack sizes: 1mg, 2mg, 5mg, 10mg, 5 mg, 1 mg.
Triazanium;[(2R,3R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-(2-octadecanoylsulfanylethylamino)-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate (CAS 799812-87-6) is a chemical compound with the molecular formula C39H79N10O17P3S and a molecular weight of 1085.1 g/mol. IUPAC name: triazanium;[(2R,3R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-(2-octadecanoylsulfanylethylamino)-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate. InChIKey: MQEBLHAOCDTGBF-BMPOWUBJSA-N.
| Molecular formula | C39H79N10O17P3S |
|---|---|
| Molecular weight | 1085.1 g/mol |
| IUPAC name | triazanium;[(2R,3R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-(2-octadecanoylsulfanylethylamino)-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate |
| InChIKey | MQEBLHAOCDTGBF-BMPOWUBJSA-N |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@@H](C([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])O.[NH4+].[NH4+].[NH4+] |
Computed by PubChem (NCBI)