Chemical Compound

CHEBI:76548

CHEBI:76548 chemical structure
Primary Record

CHEBI:76548

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
72193808
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=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
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=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

  • CHEBI:76548
  • (11Z,14Z,17Z,20Z)-3-oxohexacosatetraenoyl-CoA
  • (11Z,14Z,17Z,20Z)-3-ketohexacosatetraenoyl-CoA
  • 3-oxo-(11Z,14Z,17Z,20Z)-hexacosatetraenoyl-CoA
  • 3-keto-(11Z,14Z,17Z,20Z)-hexacosatetraenoyl-CoA
  • Q27146093
  • (11Z,14Z,17Z,20Z)-3-oxohexacosatetraenoyl-coenzyme A
  • (11Z,14Z,17Z,20Z)-3-ketohexacosatetraenoyl-coenzyme A
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(11Z,14Z,17Z,20Z)-3-oxohexacosa-11,14,17,20-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}