Chemical Compound

18:3 (n6) Coenzyme A

CAS Registry Number 27843-61-4
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18:3 (n6) Coenzyme A chemical structure
Primary Record

18:3 (n6) Coenzyme A

In stock
7,104 g
Purity
99.2 %
CAS
27843-61-4

Compound Identifiers & Properties

CAS
27843-61-4
PubChem CID
172641117
SMILES
CCCCC/C=C\C/C=C\C/C=C\CCCCC(=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.[NH4+].[NH4+].[NH4+]
Canonical SMILES
CCCCC/C=C\C/C=C\C/C=C\CCCCC(=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.[NH4+].[NH4+].[NH4+]

Names & Synonyms

  • 18:3 (n6) Coenzyme A
  • CBA84361
  • (6Z,9Z,12Z-octadecatrienoyl) Coenzyme A (ammonium salt)
  • 27843-61-4