Chemical Compound

RefChem:68162

RefChem:68162 chemical structure
Primary Record

RefChem:68162

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
86289192
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=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\C/C=C\CCCCCCCCC(=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:68162
  • CHEBI:77544
  • (10Z,13Z,16Z,19Z,22Z)-octacosapentaenoyl-CoA
  • C21967
  • (10Z,13Z,16Z,19Z,22Z)-octacosapentaenoyl-coenzyme A
  • Q27147157