Chemical Compound

Hexadecanoyl coenzyme A

CAS Registry Number 188174-64-3
Hexadecanoyl coenzyme A chemical structure
Primary Record

Hexadecanoyl coenzyme A

In stock
1,490 g
Purity
99.4 %
CAS
188174-64-3

Compound Identifiers & Properties

CAS
188174-64-3
PubChem CID
71308765
SMILES
[Li+].CCCCCCCCCCCCCCCC(=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
Canonical SMILES
CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])O.[Li+]

Names & Synonyms

  • Hexadecanoyl coenzyme A
  • n-Hexadecanoyl Coenzyme A
  • n-hexadecanoyl coenzyme a lithium salt
  • Palmitoyl coenzyme A lithium salt
  • 188174-64-3
  • orb1983256
  • Palmitoyl coenzyme A (lithium)
  • SCHEMBL31371509
  • Arachidonoyl coenzyme?A lithium salt
  • CID 71308765
  • Palmitoyl coenzyme A lithium salt, >=90%
  • G77034
  • Coenzyme A,S-hexadecanoate, lithium salt (9CI)
  • Lithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-(2-hexadecanoylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] hydrogen phosphate
  • Lithium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(((hydroxy((hydroxy((R)-3-hydroxy-2,2-dimethyl-4-oxo-4-((3-oxo-3-((2-(palmitoylthio)ethyl)amino)propyl)amino)butoxy)phosphoryl)oxy)phosphoryl)oxy)methyl)tetrahydrofuran-3-yl hydrogen phosphate
  • LITHIUM(1+) (2R,3S,4R,5R)-5-(6-AMINOPURIN-9-YL)-2-[({[(3R)-3-[(2-{[2-(HEXADECANOYLSULFANYL)ETHYL]CARBAMOYL}ETHYL)CARBAMOYL]-3-HYDROXY-2,2-DIMETHYLPROPOXY(HYDROXY)PHOSPHORYL]OXY(HYDROXY)PHOSPHORYL}OXY)METHYL]-4-HYDROXYOXOLAN-3-YL HYDROGEN PHOSPHATE