Chemical Compound

20:4 Coenzyme A

CAS Registry Number 799812-93-4
20:4 Coenzyme A chemical structure
Primary Record

20:4 Coenzyme A

In stock
4,359 g
Purity
98.3 %
CAS
799812-93-4

Compound Identifiers & Properties

CAS
799812-93-4
PubChem CID
46907897
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=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+]
Canonical SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=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(O)[C@H]1OP(=O)([O-])O.[NH4+].[NH4+].[NH4+]

Names & Synonyms

  • 20:4 Coenzyme A
  • PUBCHEM_46907897
  • 799812-93-4
  • (5Z,8Z,11Z,14Z-eicosatetraenoyl) Coenzyme A (ammonium salt)
  • 20:4 Coenzyme A, (5Z,8Z,11Z,14Z-eicosatetraenoyl) Coenzyme A (ammonium salt), powder
  • triazanium;[(2R,3R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-4-[[3-[2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]sulfanylethylamino]-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate