Chemical Compound

CHEBI:64785

CHEBI:64785 chemical structure
Primary Record

CHEBI:64785

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
57339261
SMILES
CC1=CC(=O)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)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:64785
  • Q27133423
  • [(2R)-3,3,4-trimethyl-6-oxo-3,6-dihydro-1H-pyran-2-yl]acetyl-CoA
  • [(2R)-3,3,4-trimethyl-6-oxo-3,6-dihydro-1H-pyran-2-yl]acetyl-CoA(4-)
  • 5-hydroxy-3,4,4-trimethyl-Delta2-pimeloyl-CoA-Delta-lactone