Chemical Compound

octanoyl-CoA

CAS Registry Number 1264-52-4
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octanoyl-CoA chemical structure
Primary Record

octanoyl-CoA

In stock
2,999 g
Purity
98.2 %
CAS
1264-52-4

Compound Identifiers & Properties

CAS
1264-52-4
PubChem CID
122289
SMILES
CCCCCCCC(=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(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Canonical SMILES
CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O

Names & Synonyms

  • octanoyl-CoA
  • octanoyl-coenzyme A
  • Coenzyme A, octanoyl-
  • Coenzyme A, S-octanoate
  • AC1L3UBG
  • CID122289
  • 1264-52-4
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] octanethioate