Chemical Compound

coenzyme A

CAS Registry Number 85-61-0
coenzyme A chemical structure
Primary Record

coenzyme A

In stock
8,564 g
Purity
99.4 %
CAS
85-61-0

Compound Identifiers & Properties

CAS
85-61-0
PubChem CID
317
SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCS)O
Canonical SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS

Names & Synonyms

  • coenzyme A
  • Zeel
  • Coenzyme A hydrate
  • Depot-Zeel
  • Reduced CoA
  • Coenzyme A, free acid
  • RefChem:1048869
  • 85-61-0(anhydrous)
  • UNII-SAA04E81UX
  • AC1L18YY
  • SCHEMBL26753
  • CID317
  • orb2813646
  • C21H36N7O16P3S
  • DTXSID00859136
  • S00343a
  • NSC20274
  • EINECS 201-619-0
  • MFCD24368566
  • NSC-20274
  • C21-H36-N7-O16-P3-S
  • 85-61-0
  • FT-0629029
  • NS00013541
  • [[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-sulfanylethylamino)propyl]amino]butyl] hydrogen phosphate
  • 31416-98-5
  • CoA
  • ((5-(6-Aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl)methoxy-hydroxyphosphoryl) (3-hydroxy-2,2-dimethyl-4-oxo-4-((3-oxo-3-(2-sulfanylethylamino)propyl)amino)butyl) hydrogen phosphate
  • [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-sulfanylethylamino)propyl]amino]butyl] hydrogen phosphate
  • [5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methyl 3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl dihydrogen diphosphate
  • 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-N-((Z)-3-hydroxy-3-((2-mercaptoethyl)imino)propyl)-3,3-dimethylbutanimidic acid