Products 1420-36-6

CAS 1420-36-6 appears in our catalog under these names: S-Acetoacetate coenzyme A, Acetoacetyl-CoA, S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) 3-oxobutanethioate, Acetoacetyl coenzyme A sodium salt hydra. Offered by: Biosynth, MedChemExpress, Chemat, Sigma-Aldrich. Available pack sizes: 2mg, 1mg, 5mg, 10mg, Get quote, 25mg.

S-Acetoacetate coenzyme A
Biosynth
  • size: 2mg, 1mg, 5mg, 10mg
  • Variants: 4
View product
Acetoacetyl-CoA
MedChemExpress
  • size: Get quote
  • Variants: 1
View product
S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) 3-oxobutanethioate
Chemat
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 4
from 789.20
View product
Acetoacetyl coenzyme A sodium salt hydra
Sigma-Aldrich
  • size: 10MG, 25MG, 5MG
  • Variants: 3
from 1126.90
View product
Structural formula: {0} (CAS {1})

Acetoacetyl-CoA is a 3-oxoacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of acetoacetic acid. It has a role as a mouse metabolite and an Escherichia coli metabolite. It is functionally related to an acetoacetic acid and a butyryl-CoA. It is a conjugate acid of an acetoacetyl-CoA(4-).

Source: ChEBI

Identity
Molecular formulaC25H40N7O18P3S
Molecular weight851.6 g/mol
IUPAC nameS-[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] 3-oxobutanethioate
InChIKeyOJFDKHTZOUZBOS-CITAKDKDSA-N
SMILESCC(=O)CC(=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)

Synonyms: acetoacetyl-CoA, Acetoacetyl coenzyme A, Acetoacetyl coa, 3-acetoacetyl-CoA, S-Acetoacetyl-CoA, S-acetoacetyl-coenzyme A, S-Acetoacetylcoenzyme A, acetoacetyl-coenzyme a, Acetoacetylcoenzyme A, Coenzyme A, S-acetoacetate