Chemical Compound

3-Ketostearoyl-coa

CAS Registry Number 86370-20-9
3-Ketostearoyl-coa chemical structure
Primary Record

3-Ketostearoyl-coa

In stock
1,775 g
Purity
99.1 %
CAS
86370-20-9

Compound Identifiers & Properties

CAS
86370-20-9
PubChem CID
22833664
SMILES
CCCCCCCCCCCCCCCC(=O)CC(=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
Canonical SMILES
CCCCCCCCCCCCCCCC(=O)CC(=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

Names & Synonyms

  • 3-Ketostearoyl-coa
  • 3-Oxooctadecanoyl-CoA
  • 3-Oxostearoyl-CoA
  • beta-Ketostearoyl-CoA
  • beta-Ketostearoyl-coenzyme A
  • 3-oxostearoyl-coenzyme A
  • 3-Ketostearoyl-coenzyme A
  • 3-oxooctadecanoyl-coenzyme A
  • Coenzyme A, 3-ketostearoyl-
  • SCHEMBL2317294
  • CHEBI:50571
  • CTK3E8122
  • Coenzyme A, S-(3-oxooctadecanoate)
  • DTXSID601295440
  • LMFA07050248
  • 3-Ketostearoyl-CoA; (Acyl-CoA); [M+H]+;
  • C16216
  • 86370-20-9
  • Q27122119
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxooctadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxooctadecanethioate
  • S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} 3-oxooctadecanethioate