Chemical Compound

RefChem:68255

RefChem:68255 chemical structure
Primary Record

RefChem:68255

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
71581158
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=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\CCCCCCCCCCCC(=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

  • RefChem:68255
  • C28:4(omega-6)-CoA
  • CHEBI:74489
  • (13Z,16Z,19Z,22Z)-octacosatetraenoyl-CoA
  • all-cis-octacosatetraenoyl-CoA(4-) (omega-6)
  • all-cis-octacosatetranoyl-coenzyme A (omega-6)
  • (13Z,16Z,19Z,22Z)-octacosatetraenoyl-coenzyme A
  • C21963
  • Q27144692
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(13Z,16Z,19Z,22Z)-octacosa-13,16,19,22-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • 3'-phosphoadenosine 5'-(3-((3R)-3-hydroxy-4-((3-((2-(((13Z,16Z,19Z,22Z)-octacosa-13,16,19,22-tetraenoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate)