Products 799812-78-5

CAS 799812-78-5 appears in our catalog under these names: 02:0 Coenzyme A, Acetoyl-CoA (triammonium). Offered by: Biosynth, MedChemExpress, Sigma-Aldrich. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 1 mg.

02:0 Coenzyme A
Biosynth, Sigma-Aldrich
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 6
from 2010.00
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Acetoyl-CoA (triammonium)
MedChemExpress
  • size: 1 mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

Trisodium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl] hydrogen phosphate (CAS 799812-78-5) is a chemical compound with the molecular formula C23H35N7Na3O17P3S and a molecular weight of 875.5 g/mol. IUPAC name: trisodium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl] hydrogen phosphate. InChIKey: CRTIJMBXIFKWCA-JHJDYNLLSA-K.

Identity
Molecular formulaC23H35N7Na3O17P3S
Molecular weight875.5 g/mol
IUPAC nametrisodium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl] hydrogen phosphate
InChIKeyCRTIJMBXIFKWCA-JHJDYNLLSA-K
SMILESCC(=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.[Na+].[Na+].[Na+]

Computed by PubChem (NCBI)

Synonyms: Acetyl Coenzyme A Trisodium Salt, Coenzyme A, S-acetate, trisodium salt (9CI)