Chemical Compound

CHEBI:64784

CHEBI:64784 chemical structure
Primary Record

CHEBI:64784

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
57339184
SMILES
CC1=CC(=O)[C@@H](C1(C)C)CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)([O-])[O-])O
Canonical SMILES
CC1=CC(=O)[C@H](CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)([O-])[O-])C1(C)C

Names & Synonyms

  • CHEBI:64784
  • [(1R)-2,2,3-trimethyl-5-oxocyclopent-3-enyl]acetyl-CoA
  • 2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetyl-CoA
  • Q27104920
  • [(1R)-2,2,3-trimethyl-5-oxocyclopent-3-enyl]acetyl-CoA(4-)
  • 2-oxo-Delta(3)-4,5,5-trimethylcyclopentenylacetyl-CoA
  • [(1R)-4,5,5-trimethyl-2-oxocyclopent-3-enyl]acetyl-CoA
  • 2-oxo-Delta(3)-4,5,5-trimethylcyclopentenylacetyl-coenzyme A
  • [(R)-2,2,3-trimethyl-2-oxocyclopent-3-en-1-yl]acetyl-coenzyme A(4-)