Chemical Compound

6-oxocyclohex-1-ene-1-carbonyl-CoA

6-oxocyclohex-1-ene-1-carbonyl-CoA chemical structure
Primary Record

6-oxocyclohex-1-ene-1-carbonyl-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
11966191
SMILES
CC(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)[C@H](C(=O)NCCC(=O)NCCSC(=O)C4=CCCCC4=O)O
Canonical SMILES
CC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C1=CCCCC1=O

Names & Synonyms

  • 6-oxocyclohex-1-ene-1-carbonyl-CoA
  • SCHEMBL3210414
  • SCHEMBL31038933
  • CHEBI:28168
  • 6-Ketoxycyclohex-1-ene-1-carboxyl-CoA
  • 6-oxocyclohex-1-ene-1-carbonyl-coenzyme A
  • 6-ketocyclohex-1-ene-1-carbonyl-coenzyme A
  • LMFA07050274
  • CID11966191
  • C09821
  • CHEBI:28168; (Acyl-CoA); [M+H]+;
  • Q27103539
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(6-oxocyclohex-1-ene-1-carbonyl)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] 6-oxocyclohexene-1-carbothioate