Chemical Compound

3-ketohexanoyl-CoA

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3-ketohexanoyl-CoA chemical structure
Primary Record

3-ketohexanoyl-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177866551
SMILES
[Li+].CCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])O
Canonical SMILES
CCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)([O-])O.[Li+]

Names & Synonyms

  • 3-ketohexanoyl-CoA
  • 3-Oxohexanoyl coenzyme A
  • beta-Ketohexanoyl coenzyme A
  • Coenzyme A, S-(3-oxohexanoate)
  • 3-Ketohexanoyl Coenzyme A, Lithium salt