Chemical Compound

Octanoyl coenzyme A lithium salt hydrate

CAS Registry Number 324518-20-9
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Octanoyl coenzyme A lithium salt hydrate chemical structure
Primary Record

Octanoyl coenzyme A lithium salt hydrate

In stock
1,418 g
Purity
99.4 %
CAS
324518-20-9

Compound Identifiers & Properties

CAS
324518-20-9
PubChem CID
90472068
SMILES
[Li+].CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(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.O
Canonical SMILES
CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(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.O.[Li+]

Names & Synonyms

  • Octanoyl coenzyme A lithium salt hydrate
  • Octanoyl coenzyme A (lithium)
  • octanoylcoenzymealithiumsalthydrate
  • MFCD10567452
  • 324518-20-9
  • lithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[3-hydroxy-2,2-dimethyl-4-[[3-(2-octanoylsulfanylethylamino)-3-oxopropyl]amino]-4-oxobutoxy]phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate;hydrate
  • 1078121-19-3