Chemical Compound

RefChem:69788

RefChem:69788 chemical structure
Primary Record

RefChem:69788

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
71581055
SMILES
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=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
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=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

  • RefChem:69788
  • CHEBI:73887
  • LMFA07050130
  • (7Z,10Z,13Z,16Z,19Z)-3-oxodocosapentaenoyl-CoA
  • all-cis-3-oxodocosa-7,10,13,16,19-pentaenoyl-CoA
  • (7Z,10Z,13Z,16Z,19Z)-3-oxodocosapentaenoyl-coenzyme A
  • all-cis-3-oxodocosa-7,10,13,16,19-pentaenoyl-coenzyme A
  • 7Z,10Z,13Z,16Z,19Z-3-oxodocosapentaenoyl-CoA
  • Q27144211
  • 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) (7Z,10Z,13Z,16Z,19Z)-3-oxodocosa-7,10,13,16,19-pentaenethioate
  • 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] (7Z,10Z,13Z,16Z,19Z)-3-oxodocosa-7,10,13,16,19-pentaenethioate